0 B10R1.13 C=C(C)c1cc[n+](cc1)[O-] 271570a_100000694244_100000039755 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.13 C=C(C)c1ccc(=O)[nH]c1 271570a_100000694244_100000212171 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.13 C=C(C)c1ccc(=O)[nH]n1 271570a_100000694244_100009820020 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.13 C=C(C)c1ccc(cc1)Br 271570a_100000694244_100000752885 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.13 C=C(C)c1ccc(cc1)C 271570a_100000694244_100000186775 [0,0,0,0,0,0|1,0,0]=1 5 B10R1.13 C=C(C)c1ccc(cc1)Cl 271570a_100000694244_100000755918 [0,0,0,0,0,0|2,0,0]=2 6 B10R1.13 C=C(C)c1ccc(cc1)F 271570a_100000694244_100000211213 [0,0,0,0,0,0|2,0,0]=2 7 B10R1.13 C=C(C)c1ccc(cc1)N 271570a_100000694244_100000185761 [0,0,0,0,0,0|2,0,0]=2 8 B10R1.13 C=C(C)c1ccc(cc1)O 271570a_100000694244_100000185759 [0,0,0,0,0,0|2,0,0]=2 9 B10R1.13 C=C(C)c1ccc(cc1)O 271570a_203496583355_100000185454 [0,0,0,0,0,0|2,0,0]=2 10 B10R1.13 C=C(C)c1ccc(cn1)Br 271570a_100000694244_100000686858 [0,0,0,0,0,0|3,0,0]=3 11 B10R1.13 C=C(C)c1ccc(cn1)C 271570a_100000694244_100000754016 [0,0,0,0,0,0|2,0,0]=2 12 B10R1.13 C=C(C)c1ccc(cn1)Cl 271570a_100000694244_100011356976 [0,0,0,0,0,0|3,0,0]=3 13 B10R1.13 C=C(C)c1ccc(cn1)F 271570a_100000694244_100000744514 [0,0,0,0,0,0|3,0,0]=3 14 B10R1.13 C=C(C)c1ccc(cn1)N 271570a_100000694244_100000744251 [0,0,0,0,0,0|3,0,0]=3 15 B10R1.13 C=C(C)c1ccc(cn1)O 271570a_100000694244_100000685995 [0,0,0,0,0,0|3,0,0]=3 16 B10R1.13 C=C(C)c1ccc(nc1)Br 271570a_100000694244_100009814638 [0,0,0,0,0,0|3,0,0]=3 17 B10R1.13 C=C(C)c1ccc(nc1)C 271570a_100000694244_100000751577 [0,0,0,0,0,0|2,0,0]=2 18 B10R1.13 C=C(C)c1ccc(nc1)Cl 271570a_100000694244_100000034144 [0,0,0,0,0,0|3,0,0]=3 19 B10R1.13 C=C(C)c1ccc(nc1)F 271570a_100000694244_100000748661 [0,0,0,0,0,0|3,0,0]=3 20 B10R1.13 C=C(C)c1ccc(nc1)N 271570a_100000694244_100000187370 [0,0,0,0,0,0|3,0,0]=3 21 B10R1.13 C=C(C)c1ccc(nn1)C 271570a_100000694244_100011450037 [0,0,0,0,0,0|3,0,0]=3 22 B10R1.13 C=C(C)c1ccc(nn1)N 271570a_100000694244_100009816609 [0,0,0,0,0,0|4,0,0]=4 23 B10R1.13 C=C(C)c1cnc(=O)[nH]c1 271570a_100000694244_102495366499 [0,0,0,0,0,0|4,0,0]=4 24 B10R1.13 C=C(C)c1cnc(cn1)C 271570a_100000694244_100011999403 [0,0,0,0,0,0|3,0,0]=3 25 B10R1.13 C=C(C)c1cnc(cn1)F 271570a_100000694244_100009856528 [0,0,0,0,0,0|4,0,0]=4 26 B10R1.13 C=C(C)c1cnc(cn1)N 271570a_100000694244_100000761932 [0,0,0,0,0,0|4,0,0]=4 27 B10R1.13 C=C(C)c1cnc(nc1)Br 271570a_100000694244_200012349914 [0,0,0,0,0,0|4,0,0]=4 28 B10R1.13 C=C(C)c1cnc(nc1)C 271570a_100000694244_100000686985 [0,0,0,0,0,0|3,0,0]=3 29 B10R1.13 C=C(C)c1cnc(nc1)F 271570a_100000694244_100000685262 [0,0,0,0,0,0|4,0,0]=4 30 B10R1.13 C=C(C)c1cnc(nc1)N 271570a_100000694244_100000760574 [0,0,0,0,0,0|4,0,0]=4 31 B10R1.13 C=C(C)c1ncc(cn1)Br 271570a_100000694244_100000690281 [0,0,0,0,0,0|4,0,0]=4 32 B10R1.13 C=C(C)c1ncc(cn1)C 271570a_100000694244_100011825175 [0,0,0,0,0,0|3,0,0]=3 33 B10R1.13 C=C(C)c1ncc(cn1)Cl 271570a_100000694244_100011356929 [0,0,0,0,0,0|4,0,0]=4 34 B10R1.13 C=C(C)c1ncc(cn1)F 271570a_100000694244_100000685220 [0,0,0,0,0,0|4,0,0]=4 35 B10R1.13 C=C(C)c1ncc(cn1)N 271570a_100000694244_100000068403 [0,0,0,0,0,0|4,0,0]=4 36 B10R1.13 C=C(C)c1ncc(cn1)O 271570a_100000694244_100000730009 [0,0,0,0,0,0|4,0,0]=4 37 B10R1.13 CC(=O)C1CC=C(CC1)C 1458a_100000137427_200000210301 [0,0,0,0,0,0|0,0,4]=4 38 B10R1.13 CC(=O)N1CC=C(CC1)C 11a_100000693516_100015343762 [0,0,0,0,0,0|1,0,3]=4 39 B10R1.13 CC(=O)N1CC=C(CC1)C 1626a_100000693516_100015343762 [0,0,0,0,0,0|1,0,3]=4 40 B10R1.13 CC(=O)N1CC=C(CC1)C 240690a_100000693516_100015343762 [0,0,0,0,0,0|1,0,3]=4 41 B10R1.13 CC(=O)N1CC=C(CC1)C 527a_100000693516_100103153847 [0,0,0,0,0,0|1,0,3]=4 42 B10R1.13 CC(=O)c1ccc(cc1)Br 1458a_100000185839_200000210301 [0,0,0,0,0,0|1,0,0]=1 43 B10R1.13 CC(=O)c1ccc(cc1)C 1458a_100000188618_200000210301 [0,0,0,0,0,0|0,0,0]=0 44 B10R1.13 CC(=O)c1ccc(cc1)Cl 1458a_100000210187_200000210301 [0,0,0,0,0,0|1,0,0]=1 45 B10R1.13 CC(=O)c1ccc(cc1)F 1458a_100000187176_200000210301 [0,0,0,0,0,0|1,0,0]=1 46 B10R1.13 CC(=O)c1ccc(cc1)I 1458a_100000187904_200000210301 [0,0,0,0,0,0|1,0,0]=1 47 B10R1.13 CC(=O)c1ccc(cc1)O 1458a_100000212099_200000210301 [0,0,0,0,0,0|1,0,0]=1 48 B10R1.13 CC(=O)c1ccc(cc1)O 271570a_203496583355_100000185465 [0,0,0,0,0,0|1,0,0]=1 49 B10R1.13 CC(=O)c1ccc(cn1)O 271570a_203496583355_100000686046 [0,0,0,0,0,0|2,0,0]=2 50 B10R1.13 CC(=O)c1ccc(nc1)O 271570a_203496583355_100000684857 [0,0,0,0,0,0|2,0,0]=2 51 B10R1.13 CC(=O)c1cnc(cn1)O 271570a_203496583355_100009883172 [0,0,0,0,0,0|3,0,0]=3 52 B10R1.13 CC(=O)c1cnc(nc1)O 271570a_203496583355_100000099681 [0,0,0,0,0,0|3,0,0]=3 53 B10R1.13 CC(=O)c1ncc(cn1)O 271570a_203496583355_100010077182 [0,0,0,0,0,0|3,0,0]=3 54 B10R1.13 CC(C)c1ccc(cc1)O 271570a_203496583355_100000750031 [0,0,0,0,0,0|2,0,1]=3 55 B10R1.13 CC(C)c1ccc(cn1)O 271570a_203496583355_100010255768 [0,0,0,0,0,0|3,0,1]=4 56 B10R1.13 CC(C)c1ccc(nc1)O 271570a_203496583355_200009815286 [0,0,0,0,0,0|3,0,1]=4 57 B10R1.13 CC(N)c1ccc(cn1)O 271570a_203496583355_100000723930 [0,0,0,0,0,0|3,0,1]=4 58 B10R1.13 CC(O)c1ccc(cc1)O 271570a_203496583355_100000745893 [0,0,0,0,0,0|1,0,2]=3 59 B10R1.13 CC(O)c1ccc(cn1)O 271570a_203496583355_100012353650 [0,0,0,0,0,0|2,0,2]=4 60 B10R1.13 CC(O)c1ccc(nc1)O 271570a_203496583355_200010274204 [0,0,0,0,0,0|2,0,2]=4 61 B10R1.13 CC1=CCC(CC1)C(=O)[13CH3] 1458a_100000137427_200025704644 [0,0,0,0,0,0|0,0,4]=4 62 B10R1.13 CN(C)c1ccc(cc1)Br 2230a_100000219623_200000210301 [0,0,0,0,0,0|3,0,0]=3 63 B10R1.13 CN(C)c1ccc(cc1)Br 269982a_100000219623_200000210301 [0,0,0,0,0,0|3,0,0]=3 64 B10R1.13 CN(C)c1ccc(cc1)Br 34a_100000219623_200000210301 [0,0,0,0,0,0|3,0,0]=3 65 B10R1.13 CN(C)c1ccc(cc1)Cl 2230a_100020629279_200000210301 [0,0,0,0,0,0|3,0,0]=3 66 B10R1.13 CN(C)c1ccc(cc1)Cl 269982a_100020629279_200000210301 [0,0,0,0,0,0|3,0,0]=3 67 B10R1.13 CN(C)c1ccc(cc1)Cl 34a_100020629279_200000210301 [0,0,0,0,0,0|3,0,0]=3 68 B10R1.13 CN(C)c1ccc(cc1)F 2230a_100000219829_200000210301 [0,0,0,0,0,0|3,0,0]=3 69 B10R1.13 CN(C)c1ccc(cc1)F 269982a_100000219829_200000210301 [0,0,0,0,0,0|3,0,0]=3 70 B10R1.13 CN(C)c1ccc(cc1)F 34a_100000219829_200000210301 [0,0,0,0,0,0|3,0,0]=3 71 B10R1.13 CN(C)c1ccc(cc1)I 2230a_100000743151_200000210301 [0,0,0,0,0,0|3,0,0]=3 72 B10R1.13 CN(C)c1ccc(cc1)I 269982a_100000743151_200000210301 [0,0,0,0,0,0|3,0,0]=3 73 B10R1.13 CN(C)c1ccc(cc1)I 34a_100000743151_200000210301 [0,0,0,0,0,0|3,0,0]=3 74 B10R1.13 CN(C)c1ccc(cc1)O 269982a_100000182112_200000210301 [0,0,0,0,0,0|3,0,0]=3 75 B10R1.13 CN(C)c1ccc(cc1)O 271570a_203496583355_100000210421 [0,0,0,0,0,0|3,0,0]=3 76 B10R1.13 CN(C)c1ccc(cc1)O 34a_100000182112_200000210301 [0,0,0,0,0,0|3,0,0]=3 77 B10R1.13 CN(C)c1ccc(cn1)Br 27a_100102631434_100000686858 [0,0,0,0,0,0|4,0,0]=4 78 B10R1.13 CN(C)c1ccc(cn1)O 271570a_203496583355_100011465347 [0,0,0,0,0,0|4,0,0]=4 79 B10R1.13 CN(C)c1ccc(nc1)O 271570a_203496583355_100009992925 [0,0,0,0,0,0|4,0,0]=4 80 B10R1.13 CN([13CH3])c1ccc(cc1)Br 2230a_100000219623_200025704644 [0,0,0,0,0,0|3,0,0]=3 81 B10R1.13 CN([13CH3])c1ccc(cc1)Br 269982a_100000219623_200025704644 [0,0,0,0,0,0|3,0,0]=3 82 B10R1.13 CN([13CH3])c1ccc(cc1)Br 34a_100000219623_200025704644 [0,0,0,0,0,0|3,0,0]=3 83 B10R1.13 CN([13CH3])c1ccc(cc1)Cl 2230a_100020629279_200025704644 [0,0,0,0,0,0|3,0,0]=3 84 B10R1.13 CN([13CH3])c1ccc(cc1)Cl 269982a_100020629279_200025704644 [0,0,0,0,0,0|3,0,0]=3 85 B10R1.13 CN([13CH3])c1ccc(cc1)Cl 34a_100020629279_200025704644 [0,0,0,0,0,0|3,0,0]=3 86 B10R1.13 CN([13CH3])c1ccc(cc1)F 2230a_100000219829_200025704644 [0,0,0,0,0,0|3,0,0]=3 87 B10R1.13 CN([13CH3])c1ccc(cc1)F 269982a_100000219829_200025704644 [0,0,0,0,0,0|3,0,0]=3 88 B10R1.13 CN([13CH3])c1ccc(cc1)F 34a_100000219829_200025704644 [0,0,0,0,0,0|3,0,0]=3 89 B10R1.13 CN([13CH3])c1ccc(cc1)I 2230a_100000743151_200025704644 [0,0,0,0,0,0|3,0,0]=3 90 B10R1.13 CN([13CH3])c1ccc(cc1)I 269982a_100000743151_200025704644 [0,0,0,0,0,0|3,0,0]=3 91 B10R1.13 CN([13CH3])c1ccc(cc1)I 34a_100000743151_200025704644 [0,0,0,0,0,0|3,0,0]=3 92 B10R1.13 CN([13CH3])c1ccc(cc1)O 269982a_100000182112_200025704644 [0,0,0,0,0,0|3,0,0]=3 93 B10R1.13 CN([13CH3])c1ccc(cc1)O 34a_100000182112_200025704644 [0,0,0,0,0,0|3,0,0]=3 94 B10R1.13 CS(=O)c1ccc(cc1)O 271570a_203496583355_100009816266 [0,0,0,0,0,0|2,0,0]=2 95 B10R1.13 CS(=O)c1ncc(cn1)O 271570a_203496583355_100010117237 [0,0,0,0,0,0|4,0,0]=4 96 B10R1.13 C[C@@H](N)c1ccc(cc1)O 271570a_203496583355_100000720352 [0,0,0,0,0,0|2,0,1]=3 97 B10R1.13 C[C@H](N)c1ccc(cc1)O 271570a_203496583355_100000753911 [0,0,0,0,0,0|2,0,1]=3 98 B10R1.13 C[C@H](N)c1ccc(nc1)O 271570a_203496583355_100015387476 [0,0,0,0,0,0|3,0,1]=4 99 B10R1.13 Cc1ccc(cc1)C(=O)[13CH3] 1458a_100000188618_200025704644 [0,0,0,0,0,0|0,0,0]=0 100 B10R1.13 Cc1ccc(cc1)N(C)C 2230a_100000219977_200000210301 [0,0,0,0,0,0|2,0,0]=2 101 B10R1.13 Cc1ccc(cc1)N(C)C 269982a_100000219977_200000210301 [0,0,0,0,0,0|2,0,0]=2 102 B10R1.13 Cc1ccc(cc1)N(C)C 34a_100000219977_200000210301 [0,0,0,0,0,0|2,0,0]=2 103 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 2230a_100000219977_200025704644 [0,0,0,0,0,0|2,0,0]=2 104 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 269982a_100000219977_200025704644 [0,0,0,0,0,0|2,0,0]=2 105 B10R1.13 Cc1ccc(cc1)N(C)[13CH3] 34a_100000219977_200025704644 [0,0,0,0,0,0|2,0,0]=2 106 B10R1.13 Cc1ccc(nn1)N(C)C 27a_100102631434_100000744512 [0,0,0,0,0,0|4,0,0]=4 107 B10R1.13 Cc1cnc(cn1)N(C)C 27a_100102631434_100000074397 [0,0,0,0,0,0|4,0,0]=4 108 B10R1.13 Cc1cnc(nc1)N(C)C 27a_100102631434_100000061069 [0,0,0,0,0,0|4,0,0]=4 109 B10R1.13 NC(=O)c1ccc(cc1)O 271570a_203496583355_100000162191 [0,0,0,0,0,0|2,0,0]=2 110 B10R1.13 NC(=O)c1ccc(cn1)O 271570a_203496583355_100011219284 [0,0,0,0,0,0|3,0,0]=3 111 B10R1.13 NC(=O)c1ccc(nc1)O 271570a_203496583355_100000162237 [0,0,0,0,0,0|3,0,0]=3 112 B10R1.13 NC(=O)c1ccc(nn1)O 271570a_203496583355_100000761398 [0,0,0,0,0,0|4,0,0]=4 113 B10R1.13 NC(=O)c1cnc(cn1)O 271570a_203496583355_100000738300 [0,0,0,0,0,0|4,0,0]=4 114 B10R1.13 NC(=O)c1ncc(cn1)O 271570a_203496583355_100009996756 [0,0,0,0,0,0|4,0,0]=4 115 B10R1.13 OB(O)c1ccc(cc1)O 271570a_203496583355_100000754493 [0,0,0,0,0,0|3,0,1]=4 116 B10R1.13 Oc1ccc(cc1)C(F)F 271570a_203496583355_100010189923 [0,0,0,0,0,0|3,0,1]=4 117 B10R1.13 [13CH3]C(=O)c1ccc(cc1)Br 1458a_100000185839_200025704644 [0,0,0,0,0,0|1,0,0]=1 118 B10R1.13 [13CH3]C(=O)c1ccc(cc1)Cl 1458a_100000210187_200025704644 [0,0,0,0,0,0|1,0,0]=1 119 B10R1.13 [13CH3]C(=O)c1ccc(cc1)F 1458a_100000187176_200025704644 [0,0,0,0,0,0|1,0,0]=1 120 B10R1.13 [13CH3]C(=O)c1ccc(cc1)I 1458a_100000187904_200025704644 [0,0,0,0,0,0|1,0,0]=1 121 B10R1.13 [13CH3]C(=O)c1ccc(cc1)O 1458a_100000212099_200025704644 [0,0,0,0,0,0|1,0,0]=1 122 B9R1.1 C=Cc1cc[n+](cc1)[O-] 271570a_100011290941_100000039755 [1,0,0,0,0,0|2,0,1]=4 123 B9R1.1 C=Cc1ccc(=O)[nH]c1 271570a_100011290941_100000212171 [1,0,0,0,0,0|2,0,1]=4 124 B9R1.1 C=Cc1ccc(cc1)Br 271570a_100011290941_100000752885 [1,0,0,0,0,0|1,0,1]=3 125 B9R1.1 C=Cc1ccc(cc1)C 271570a_100011290941_100000186775 [1,0,0,0,0,0|0,0,1]=2 126 B9R1.1 C=Cc1ccc(cc1)Cl 271570a_100011290941_100000755918 [1,0,0,0,0,0|1,0,1]=3 127 B9R1.1 C=Cc1ccc(cc1)F 271570a_100011290941_100000211213 [1,0,0,0,0,0|1,0,1]=3 128 B9R1.1 C=Cc1ccc(cc1)N 271570a_100011290941_100000185761 [1,0,0,0,0,0|1,0,1]=3 129 B9R1.1 C=Cc1ccc(cc1)O 271570a_100011290941_100000185759 [1,0,0,0,0,0|1,0,1]=3 130 B9R1.1 C=Cc1ccc(cn1)Br 271570a_100011290941_100000686858 [1,0,0,0,0,0|2,0,1]=4 131 B9R1.1 C=Cc1ccc(cn1)C 271570a_100011290941_100000754016 [1,0,0,0,0,0|1,0,1]=3 132 B9R1.1 C=Cc1ccc(cn1)Cl 271570a_100011290941_100011356976 [1,0,0,0,0,0|2,0,1]=4 133 B9R1.1 C=Cc1ccc(cn1)F 271570a_100011290941_100000744514 [1,0,0,0,0,0|2,0,1]=4 134 B9R1.1 C=Cc1ccc(cn1)N 271570a_100011290941_100000744251 [1,0,0,0,0,0|2,0,1]=4 135 B9R1.1 C=Cc1ccc(cn1)O 271570a_100011290941_100000685995 [1,0,0,0,0,0|2,0,1]=4 136 B9R1.1 C=Cc1ccc(nc1)Br 271570a_100011290941_100009814638 [1,0,0,0,0,0|2,0,1]=4 137 B9R1.1 C=Cc1ccc(nc1)C 271570a_100011290941_100000751577 [1,0,0,0,0,0|1,0,1]=3 138 B9R1.1 C=Cc1ccc(nc1)Cl 271570a_100011290941_100000034144 [1,0,0,0,0,0|2,0,1]=4 139 B9R1.1 C=Cc1ccc(nc1)F 271570a_100011290941_100000748661 [1,0,0,0,0,0|2,0,1]=4 140 B9R1.1 C=Cc1ccc(nc1)N 271570a_100011290941_100000187370 [1,0,0,0,0,0|2,0,1]=4 141 B9R1.1 C=Cc1ccc(nn1)C 271570a_100011290941_100011450037 [1,0,0,0,0,0|2,0,1]=4 142 B9R1.1 C=Cc1cnc(cn1)C 271570a_100011290941_100011999403 [1,0,0,0,0,0|2,0,1]=4 143 B9R1.1 C=Cc1cnc(nc1)C 271570a_100011290941_100000686985 [1,0,0,0,0,0|2,0,1]=4 144 B9R1.1 C=Cc1ncc(cn1)C 271570a_100011290941_100011825175 [1,0,0,0,0,0|2,0,1]=4 145 B9R1.1 CCc1ccc(cc1)O 271570a_203496583355_100011215824 [1,0,0,0,0,0|1,0,1]=3 146 B9R1.1 CCc1ccc(cn1)O 271570a_203496583355_100009820025 [1,0,0,0,0,0|2,0,1]=4 147 B9R1.1 CCc1ccc(nc1)O 271570a_203496583355_100009843584 [1,0,0,0,0,0|2,0,1]=4 148 B9R1.1 CNc1ccc(cc1)Br 2230a_100000210018_200000210301 [1,0,0,0,0,0|2,0,0]=3 149 B9R1.1 CNc1ccc(cc1)Br 34a_100000210018_200000210301 [1,0,0,0,0,0|2,0,0]=3 150 B9R1.1 CNc1ccc(cc1)C 34a_100000124888_200000210301 [1,0,0,0,0,0|1,0,0]=2 151 B9R1.1 CNc1ccc(cc1)Cl 2230a_100000210052_200000210301 [1,0,0,0,0,0|2,0,0]=3 152 B9R1.1 CNc1ccc(cc1)Cl 34a_100000210052_200000210301 [1,0,0,0,0,0|2,0,0]=3 153 B9R1.1 CNc1ccc(cc1)F 34a_100000185862_200000210301 [1,0,0,0,0,0|2,0,0]=3 154 B9R1.1 CNc1ccc(cc1)I 34a_100000185761_200000210301 [1,0,0,0,0,0|2,0,0]=3 155 B9R1.1 CNc1ccc(cc1)O 271570a_203496583355_100000219623 [1,0,0,0,0,0|2,0,0]=3 156 B9R1.1 CNc1ccc(cc1)O 34a_100000185829_200000210301 [1,0,0,0,0,0|2,0,0]=3 157 B9R1.1 CNc1ccc(cn1)Br 27a_100102657272_100000686858 [1,0,0,0,0,0|3,0,0]=4 158 B9R1.1 CNc1ccc(cn1)O 271570a_203496583355_100000741341 [1,0,0,0,0,0|3,0,0]=4 159 B9R1.1 CNc1ccc(nc1)O 271570a_203496583355_100000764248 [1,0,0,0,0,0|3,0,0]=4 160 B9R1.1 CNc1ccc(nn1)C 27a_100102657272_100000744512 [1,0,0,0,0,0|3,0,0]=4 161 B9R1.1 CNc1cnc(cn1)C 27a_100102657272_100000074397 [1,0,0,0,0,0|3,0,0]=4 162 B9R1.1 CNc1ncc(cn1)C 27a_100102657272_100000061069 [1,0,0,0,0,0|3,0,0]=4 163 B9R1.1 COc1ccc(=O)[nH]c1 34a_100000075641_200000210301 [1,0,0,0,0,0|3,0,0]=4 164 B9R1.1 COc1ccc(cc1)Br 34a_100000185759_200000210301 [1,0,0,0,0,0|2,0,0]=3 165 B9R1.1 COc1ccc(cc1)Br 7a_100000185759_200000210301 [1,0,0,0,0,0|2,0,0]=3 166 B9R1.1 COc1ccc(cc1)C 34a_100000210336_200000210301 [1,0,0,0,0,0|1,0,0]=2 167 B9R1.1 COc1ccc(cc1)C 7a_100000210336_200000210301 [1,0,0,0,0,0|1,0,0]=2 168 B9R1.1 COc1ccc(cc1)Cl 34a_100000210216_200000210301 [1,0,0,0,0,0|2,0,0]=3 169 B9R1.1 COc1ccc(cc1)Cl 7a_100000210216_200000210301 [1,0,0,0,0,0|2,0,0]=3 170 B9R1.1 COc1ccc(cc1)F 34a_100000210339_200000210301 [1,0,0,0,0,0|2,0,0]=3 171 B9R1.1 COc1ccc(cc1)I 34a_100000212066_200000210301 [1,0,0,0,0,0|2,0,0]=3 172 B9R1.1 COc1ccc(cc1)I 7a_100000212066_200000210301 [1,0,0,0,0,0|2,0,0]=3 173 B9R1.1 COc1ccc(cc1)N 34a_100000185829_200000210301 [1,0,0,0,0,0|2,0,0]=3 174 B9R1.1 COc1ccc(cc1)O 271570a_203496583355_100000171711 [1,0,0,0,0,0|2,0,0]=3 175 B9R1.1 COc1ccc(cn1)C 34a_100000759353_200000210301 [1,0,0,0,0,0|2,0,0]=3 176 B9R1.1 COc1ccc(cn1)Cl 34a_100011215309_200000210301 [1,0,0,0,0,0|3,0,0]=4 177 B9R1.1 COc1ccc(cn1)F 34a_100000742473_200000210301 [1,0,0,0,0,0|3,0,0]=4 178 B9R1.1 COc1ccc(cn1)N 34a_100000729260_200000210301 [1,0,0,0,0,0|3,0,0]=4 179 B9R1.1 COc1ccc(cn1)O 271570a_203496583355_100000047065 [1,0,0,0,0,0|3,0,0]=4 180 B9R1.1 COc1ccc(nc1)Br 34a_100000685995_200000210301 [1,0,0,0,0,0|3,0,0]=4 181 B9R1.1 COc1ccc(nc1)Br 7a_100000685995_200000210301 [1,0,0,0,0,0|3,0,0]=4 182 B9R1.1 COc1ccc(nc1)C 34a_100000745506_200000210301 [1,0,0,0,0,0|2,0,0]=3 183 B9R1.1 COc1ccc(nc1)C 7a_100000745506_200000210301 [1,0,0,0,0,0|2,0,0]=3 184 B9R1.1 COc1ccc(nc1)Cl 34a_100000744096_200000210301 [1,0,0,0,0,0|3,0,0]=4 185 B9R1.1 COc1ccc(nc1)Cl 7a_100000744096_200000210301 [1,0,0,0,0,0|3,0,0]=4 186 B9R1.1 COc1ccc(nc1)F 34a_100000688820_200000210301 [1,0,0,0,0,0|3,0,0]=4 187 B9R1.1 COc1ccc(nc1)F 7a_100000688820_200000210301 [1,0,0,0,0,0|3,0,0]=4 188 B9R1.1 COc1ccc(nc1)I 34a_100000687607_200000210301 [1,0,0,0,0,0|3,0,0]=4 189 B9R1.1 COc1ccc(nc1)I 7a_100000687607_200000210301 [1,0,0,0,0,0|3,0,0]=4 190 B9R1.1 COc1ccc(nc1)N 34a_100015188713_200000210301 [1,0,0,0,0,0|3,0,0]=4 191 B9R1.1 COc1ccc(nc1)N 7a_100015188713_200000210301 [1,0,0,0,0,0|3,0,0]=4 192 B9R1.1 COc1ccc(nc1)O 271570a_203496583355_100000755202 [1,0,0,0,0,0|3,0,0]=4 193 B9R1.1 COc1cnc(nc1)C 34a_100000062939_200000210301 [1,0,0,0,0,0|3,0,0]=4 194 B9R1.1 COc1cnc(nc1)C 7a_100000062939_200000210301 [1,0,0,0,0,0|3,0,0]=4 195 B9R1.1 CSc1cc[n+](cc1)[O-] 62a_200000210301_100000039755 [1,0,0,0,0,0|3,0,0]=4 196 B9R1.1 CSc1ccc(=O)[nH]c1 62a_100000212171_200000210301 [1,0,0,0,0,0|3,0,0]=4 197 B9R1.1 CSc1ccc(=O)[nH]c1 62a_200000210301_100000212171 [1,0,0,0,0,0|3,0,0]=4 198 B9R1.1 CSc1ccc(cc1)Br 62a_100000752885_200000210301 [1,0,0,0,0,0|2,0,0]=3 199 B9R1.1 CSc1ccc(cc1)Br 62a_200000210301_100000752885 [1,0,0,0,0,0|2,0,0]=3 200 B9R1.1 CSc1ccc(cc1)C 62a_100000186775_200000210301 [1,0,0,0,0,0|1,0,0]=2 201 B9R1.1 CSc1ccc(cc1)C 62a_200000210301_100000186775 [1,0,0,0,0,0|1,0,0]=2 202 B9R1.1 CSc1ccc(cc1)Cl 62a_100000755918_200000210301 [1,0,0,0,0,0|2,0,0]=3 203 B9R1.1 CSc1ccc(cc1)Cl 62a_200000210301_100000755918 [1,0,0,0,0,0|2,0,0]=3 204 B9R1.1 CSc1ccc(cc1)F 62a_100000211213_200000210301 [1,0,0,0,0,0|2,0,0]=3 205 B9R1.1 CSc1ccc(cc1)F 62a_200000210301_100000211213 [1,0,0,0,0,0|2,0,0]=3 206 B9R1.1 CSc1ccc(cc1)N 62a_100000185761_200000210301 [1,0,0,0,0,0|2,0,0]=3 207 B9R1.1 CSc1ccc(cc1)N 62a_200000210301_100000185761 [1,0,0,0,0,0|2,0,0]=3 208 B9R1.1 CSc1ccc(cc1)O 271570a_203496583355_100011263217 [1,0,0,0,0,0|2,0,0]=3 209 B9R1.1 CSc1ccc(cc1)O 62a_200000210301_100000185759 [1,0,0,0,0,0|2,0,0]=3 210 B9R1.1 CSc1ccc(cn1)Br 62a_100000686858_200000210301 [1,0,0,0,0,0|3,0,0]=4 211 B9R1.1 CSc1ccc(cn1)Br 62a_200000210301_100000686858 [1,0,0,0,0,0|3,0,0]=4 212 B9R1.1 CSc1ccc(cn1)C 62a_100011192072_200000210301 [1,0,0,0,0,0|2,0,0]=3 213 B9R1.1 CSc1ccc(cn1)C 62a_200000210301_100000754016 [1,0,0,0,0,0|2,0,0]=3 214 B9R1.1 CSc1ccc(cn1)Cl 62a_100011356976_200000210301 [1,0,0,0,0,0|3,0,0]=4 215 B9R1.1 CSc1ccc(cn1)Cl 62a_200000210301_100011356976 [1,0,0,0,0,0|3,0,0]=4 216 B9R1.1 CSc1ccc(cn1)F 62a_100000744514_200000210301 [1,0,0,0,0,0|3,0,0]=4 217 B9R1.1 CSc1ccc(cn1)F 62a_200000210301_100000744514 [1,0,0,0,0,0|3,0,0]=4 218 B9R1.1 CSc1ccc(cn1)N 62a_100000737798_200000210301 [1,0,0,0,0,0|3,0,0]=4 219 B9R1.1 CSc1ccc(cn1)N 62a_200000210301_100000737798 [1,0,0,0,0,0|3,0,0]=4 220 B9R1.1 CSc1ccc(cn1)O 271570a_203496583355_100011408404 [1,0,0,0,0,0|3,0,0]=4 221 B9R1.1 CSc1ccc(cn1)O 62a_100000685995_200000210301 [1,0,0,0,0,0|3,0,0]=4 222 B9R1.1 CSc1ccc(cn1)O 62a_200000210301_100000744096 [1,0,0,0,0,0|3,0,0]=4 223 B9R1.1 CSc1ccc(nc1)Br 62a_100009814638_200000210301 [1,0,0,0,0,0|3,0,0]=4 224 B9R1.1 CSc1ccc(nc1)Br 62a_200000210301_100009814638 [1,0,0,0,0,0|3,0,0]=4 225 B9R1.1 CSc1ccc(nc1)C 62a_100000751577_200000210301 [1,0,0,0,0,0|2,0,0]=3 226 B9R1.1 CSc1ccc(nc1)C 62a_200000210301_100000751577 [1,0,0,0,0,0|2,0,0]=3 227 B9R1.1 CSc1ccc(nc1)Cl 62a_100000034144_200000210301 [1,0,0,0,0,0|3,0,0]=4 228 B9R1.1 CSc1ccc(nc1)Cl 62a_200000210301_100000034144 [1,0,0,0,0,0|3,0,0]=4 229 B9R1.1 CSc1ccc(nc1)F 62a_100000042367_200000210301 [1,0,0,0,0,0|3,0,0]=4 230 B9R1.1 CSc1ccc(nc1)F 62a_200000210301_100000042367 [1,0,0,0,0,0|3,0,0]=4 231 B9R1.1 CSc1ccc(nc1)N 62a_100000187370_200000210301 [1,0,0,0,0,0|3,0,0]=4 232 B9R1.1 CSc1ccc(nc1)N 62a_200000210301_100000187370 [1,0,0,0,0,0|3,0,0]=4 233 B9R1.1 CSc1ccc(nc1)O 271570a_203496583355_100009820866 [1,0,0,0,0,0|3,0,0]=4 234 B9R1.1 CSc1ccc(nn1)C 62a_100000744512_200000210301 [1,0,0,0,0,0|3,0,0]=4 235 B9R1.1 CSc1ccc(nn1)C 62a_200000210301_100000744512 [1,0,0,0,0,0|3,0,0]=4 236 B9R1.1 CSc1cnc(cn1)C 62a_100011999403_200000210301 [1,0,0,0,0,0|3,0,0]=4 237 B9R1.1 CSc1cnc(cn1)C 62a_200000210301_100011999403 [1,0,0,0,0,0|3,0,0]=4 238 B9R1.1 CSc1cnc(nc1)C 62a_100000686985_200000210301 [1,0,0,0,0,0|3,0,0]=4 239 B9R1.1 CSc1cnc(nc1)C 62a_200000210301_100000686985 [1,0,0,0,0,0|3,0,0]=4 240 B9R1.1 CSc1ncc(cn1)C 62a_100000061069_200000210301 [1,0,0,0,0,0|3,0,0]=4 241 B9R1.1 CSc1ncc(cn1)C 62a_200000210301_100000061069 [1,0,0,0,0,0|3,0,0]=4 242 B9R1.1 Cc1ccc(cc1)N[13CH3] 34a_100000124888_200025704644 [1,0,0,0,0,0|1,0,0]=2 243 B9R1.1 Cc1ccc(cc1)O[13CH3] 34a_100000210336_200025704644 [1,0,0,0,0,0|1,0,0]=2 244 B9R1.1 Cc1ccc(cc1)O[13CH3] 7a_100000210336_200025704644 [1,0,0,0,0,0|1,0,0]=2 245 B9R1.1 Cc1ccc(cc1)S[13CH3] 62a_100000186775_200025704644 [1,0,0,0,0,0|1,0,0]=2 246 B9R1.1 Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000186775 [1,0,0,0,0,0|1,0,0]=2 247 B9R1.1 Cc1ccc(cn1)O[13CH3] 34a_100000745506_200025704644 [1,0,0,0,0,0|2,0,0]=3 248 B9R1.1 Cc1ccc(cn1)O[13CH3] 7a_100000745506_200025704644 [1,0,0,0,0,0|2,0,0]=3 249 B9R1.1 Cc1ccc(cn1)S[13CH3] 62a_100000751577_200025704644 [1,0,0,0,0,0|2,0,0]=3 250 B9R1.1 Cc1ccc(cn1)S[13CH3] 62a_200025704644_100000751577 [1,0,0,0,0,0|2,0,0]=3 251 B9R1.1 Cc1ccc(nc1)O[13CH3] 34a_100000759353_200025704644 [1,0,0,0,0,0|2,0,0]=3 252 B9R1.1 Cc1ccc(nc1)S[13CH3] 62a_100011192072_200025704644 [1,0,0,0,0,0|2,0,0]=3 253 B9R1.1 Cc1ccc(nc1)S[13CH3] 62a_200025704644_100000754016 [1,0,0,0,0,0|2,0,0]=3 254 B9R1.1 Cc1ccc(nn1)S[13CH3] 62a_100000744512_200025704644 [1,0,0,0,0,0|3,0,0]=4 255 B9R1.1 Cc1ccc(nn1)S[13CH3] 62a_200025704644_100000744512 [1,0,0,0,0,0|3,0,0]=4 256 B9R1.1 Cc1cnc(cn1)S[13CH3] 62a_100011999403_200025704644 [1,0,0,0,0,0|3,0,0]=4 257 B9R1.1 Cc1cnc(cn1)S[13CH3] 62a_200025704644_100011999403 [1,0,0,0,0,0|3,0,0]=4 258 B9R1.1 Cc1cnc(nc1)S[13CH3] 62a_100000061069_200025704644 [1,0,0,0,0,0|3,0,0]=4 259 B9R1.1 Cc1cnc(nc1)S[13CH3] 62a_200025704644_100000061069 [1,0,0,0,0,0|3,0,0]=4 260 B9R1.1 Cc1ncc(cn1)O[13CH3] 34a_100000062939_200025704644 [1,0,0,0,0,0|3,0,0]=4 261 B9R1.1 Cc1ncc(cn1)O[13CH3] 7a_100000062939_200025704644 [1,0,0,0,0,0|3,0,0]=4 262 B9R1.1 Cc1ncc(cn1)S[13CH3] 62a_100000686985_200025704644 [1,0,0,0,0,0|3,0,0]=4 263 B9R1.1 Cc1ncc(cn1)S[13CH3] 62a_200025704644_100000686985 [1,0,0,0,0,0|3,0,0]=4 264 B9R1.1 N#Cc1ccc(cc1)O 271570a_203496583355_100000179745 [1,0,0,0,0,0|2,0,1]=4 265 B9R1.1 NCc1ccc(cc1)O 271570a_203496583355_100016989417 [1,0,0,0,0,0|2,0,1]=4 266 B9R1.1 NNc1ccc(cc1)O 271570a_203496583355_100016988836 [1,0,0,0,0,0|3,0,0]=4 267 B9R1.1 O=Cc1ccc(cc1)O 271570a_203496583355_100000186029 [1,0,0,0,0,0|1,0,0]=2 268 B9R1.1 O=Cc1ccc(cn1)O 271570a_203496583355_100000754260 [1,0,0,0,0,0|2,0,0]=3 269 B9R1.1 O=Cc1ccc(nc1)O 271570a_203496583355_100000766901 [1,0,0,0,0,0|2,0,0]=3 270 B9R1.1 O=Cc1ccc(nn1)O 271570a_203496583355_100000044651 [1,0,0,0,0,0|3,0,0]=4 271 B9R1.1 O=Cc1cnc(cn1)O 271570a_203496583355_100012001714 [1,0,0,0,0,0|3,0,0]=4 272 B9R1.1 O=Cc1cnc(nc1)O 271570a_203496583355_100000070856 [1,0,0,0,0,0|3,0,0]=4 273 B9R1.1 OCc1ccc(cc1)O 271570a_203496583355_100000690907 [1,0,0,0,0,0|1,0,2]=4 274 B9R1.1 Oc1ccc(cc1)CF 271570a_203496583355_100010268989 [1,0,0,0,0,0|2,0,1]=4 275 B9R1.1 [13CH3]Nc1ccc(cc1)Br 2230a_100000210018_200025704644 [1,0,0,0,0,0|2,0,0]=3 276 B9R1.1 [13CH3]Nc1ccc(cc1)Br 34a_100000210018_200025704644 [1,0,0,0,0,0|2,0,0]=3 277 B9R1.1 [13CH3]Nc1ccc(cc1)Cl 2230a_100000210052_200025704644 [1,0,0,0,0,0|2,0,0]=3 278 B9R1.1 [13CH3]Nc1ccc(cc1)Cl 34a_100000210052_200025704644 [1,0,0,0,0,0|2,0,0]=3 279 B9R1.1 [13CH3]Nc1ccc(cc1)F 34a_100000185862_200025704644 [1,0,0,0,0,0|2,0,0]=3 280 B9R1.1 [13CH3]Nc1ccc(cc1)I 34a_100000185761_200025704644 [1,0,0,0,0,0|2,0,0]=3 281 B9R1.1 [13CH3]Nc1ccc(cc1)O 34a_100000185829_200025704644 [1,0,0,0,0,0|2,0,0]=3 282 B9R1.1 [13CH3]Oc1ccc(=O)[nH]c1 34a_100000075641_200025704644 [1,0,0,0,0,0|3,0,0]=4 283 B9R1.1 [13CH3]Oc1ccc(cc1)Br 34a_100000185759_200025704644 [1,0,0,0,0,0|2,0,0]=3 284 B9R1.1 [13CH3]Oc1ccc(cc1)Br 7a_100000185759_200025704644 [1,0,0,0,0,0|2,0,0]=3 285 B9R1.1 [13CH3]Oc1ccc(cc1)Cl 34a_100000210216_200025704644 [1,0,0,0,0,0|2,0,0]=3 286 B9R1.1 [13CH3]Oc1ccc(cc1)Cl 7a_100000210216_200025704644 [1,0,0,0,0,0|2,0,0]=3 287 B9R1.1 [13CH3]Oc1ccc(cc1)F 34a_100000210339_200025704644 [1,0,0,0,0,0|2,0,0]=3 288 B9R1.1 [13CH3]Oc1ccc(cc1)I 34a_100000212066_200025704644 [1,0,0,0,0,0|2,0,0]=3 289 B9R1.1 [13CH3]Oc1ccc(cc1)I 7a_100000212066_200025704644 [1,0,0,0,0,0|2,0,0]=3 290 B9R1.1 [13CH3]Oc1ccc(cc1)N 34a_100000185829_200025704644 [1,0,0,0,0,0|2,0,0]=3 291 B9R1.1 [13CH3]Oc1ccc(cn1)Cl 34a_100011215309_200025704644 [1,0,0,0,0,0|3,0,0]=4 292 B9R1.1 [13CH3]Oc1ccc(cn1)F 34a_100000742473_200025704644 [1,0,0,0,0,0|3,0,0]=4 293 B9R1.1 [13CH3]Oc1ccc(cn1)N 34a_100000729260_200025704644 [1,0,0,0,0,0|3,0,0]=4 294 B9R1.1 [13CH3]Oc1ccc(nc1)Br 34a_100000685995_200025704644 [1,0,0,0,0,0|3,0,0]=4 295 B9R1.1 [13CH3]Oc1ccc(nc1)Br 7a_100000685995_200025704644 [1,0,0,0,0,0|3,0,0]=4 296 B9R1.1 [13CH3]Oc1ccc(nc1)Cl 34a_100000744096_200025704644 [1,0,0,0,0,0|3,0,0]=4 297 B9R1.1 [13CH3]Oc1ccc(nc1)Cl 7a_100000744096_200025704644 [1,0,0,0,0,0|3,0,0]=4 298 B9R1.1 [13CH3]Oc1ccc(nc1)F 34a_100000688820_200025704644 [1,0,0,0,0,0|3,0,0]=4 299 B9R1.1 [13CH3]Oc1ccc(nc1)F 7a_100000688820_200025704644 [1,0,0,0,0,0|3,0,0]=4 300 B9R1.1 [13CH3]Oc1ccc(nc1)I 34a_100000687607_200025704644 [1,0,0,0,0,0|3,0,0]=4 301 B9R1.1 [13CH3]Oc1ccc(nc1)I 7a_100000687607_200025704644 [1,0,0,0,0,0|3,0,0]=4 302 B9R1.1 [13CH3]Oc1ccc(nc1)N 34a_100015188713_200025704644 [1,0,0,0,0,0|3,0,0]=4 303 B9R1.1 [13CH3]Oc1ccc(nc1)N 7a_100015188713_200025704644 [1,0,0,0,0,0|3,0,0]=4 304 B9R1.1 [13CH3]Sc1cc[n+](cc1)[O-] 62a_200025704644_100000039755 [1,0,0,0,0,0|3,0,0]=4 305 B9R1.1 [13CH3]Sc1ccc(=O)[nH]c1 62a_100000212171_200025704644 [1,0,0,0,0,0|3,0,0]=4 306 B9R1.1 [13CH3]Sc1ccc(=O)[nH]c1 62a_200025704644_100000212171 [1,0,0,0,0,0|3,0,0]=4 307 B9R1.1 [13CH3]Sc1ccc(cc1)Br 62a_100000752885_200025704644 [1,0,0,0,0,0|2,0,0]=3 308 B9R1.1 [13CH3]Sc1ccc(cc1)Br 62a_200025704644_100000752885 [1,0,0,0,0,0|2,0,0]=3 309 B9R1.1 [13CH3]Sc1ccc(cc1)Cl 62a_100000755918_200025704644 [1,0,0,0,0,0|2,0,0]=3 310 B9R1.1 [13CH3]Sc1ccc(cc1)Cl 62a_200025704644_100000755918 [1,0,0,0,0,0|2,0,0]=3 311 B9R1.1 [13CH3]Sc1ccc(cc1)F 62a_100000211213_200025704644 [1,0,0,0,0,0|2,0,0]=3 312 B9R1.1 [13CH3]Sc1ccc(cc1)F 62a_200025704644_100000211213 [1,0,0,0,0,0|2,0,0]=3 313 B9R1.1 [13CH3]Sc1ccc(cc1)N 62a_100000185761_200025704644 [1,0,0,0,0,0|2,0,0]=3 314 B9R1.1 [13CH3]Sc1ccc(cc1)N 62a_200025704644_100000185761 [1,0,0,0,0,0|2,0,0]=3 315 B9R1.1 [13CH3]Sc1ccc(cc1)O 62a_200025704644_100000185759 [1,0,0,0,0,0|2,0,0]=3 316 B9R1.1 [13CH3]Sc1ccc(cn1)Br 62a_100000686858_200025704644 [1,0,0,0,0,0|3,0,0]=4 317 B9R1.1 [13CH3]Sc1ccc(cn1)Br 62a_200025704644_100000686858 [1,0,0,0,0,0|3,0,0]=4 318 B9R1.1 [13CH3]Sc1ccc(cn1)Cl 62a_100011356976_200025704644 [1,0,0,0,0,0|3,0,0]=4 319 B9R1.1 [13CH3]Sc1ccc(cn1)Cl 62a_200025704644_100011356976 [1,0,0,0,0,0|3,0,0]=4 320 B9R1.1 [13CH3]Sc1ccc(cn1)F 62a_100000744514_200025704644 [1,0,0,0,0,0|3,0,0]=4 321 B9R1.1 [13CH3]Sc1ccc(cn1)F 62a_200025704644_100000744514 [1,0,0,0,0,0|3,0,0]=4 322 B9R1.1 [13CH3]Sc1ccc(cn1)N 62a_100000737798_200025704644 [1,0,0,0,0,0|3,0,0]=4 323 B9R1.1 [13CH3]Sc1ccc(cn1)N 62a_200025704644_100000737798 [1,0,0,0,0,0|3,0,0]=4 324 B9R1.1 [13CH3]Sc1ccc(cn1)O 62a_100000685995_200025704644 [1,0,0,0,0,0|3,0,0]=4 325 B9R1.1 [13CH3]Sc1ccc(cn1)O 62a_200025704644_100000744096 [1,0,0,0,0,0|3,0,0]=4 326 B9R1.1 [13CH3]Sc1ccc(nc1)Br 62a_100009814638_200025704644 [1,0,0,0,0,0|3,0,0]=4 327 B9R1.1 [13CH3]Sc1ccc(nc1)Br 62a_200025704644_100009814638 [1,0,0,0,0,0|3,0,0]=4 328 B9R1.1 [13CH3]Sc1ccc(nc1)Cl 62a_100000034144_200025704644 [1,0,0,0,0,0|3,0,0]=4 329 B9R1.1 [13CH3]Sc1ccc(nc1)Cl 62a_200025704644_100000034144 [1,0,0,0,0,0|3,0,0]=4 330 B9R1.1 [13CH3]Sc1ccc(nc1)F 62a_100000042367_200025704644 [1,0,0,0,0,0|3,0,0]=4 331 B9R1.1 [13CH3]Sc1ccc(nc1)F 62a_200025704644_100000042367 [1,0,0,0,0,0|3,0,0]=4 332 B9R1.1 [13CH3]Sc1ccc(nc1)N 62a_100000187370_200025704644 [1,0,0,0,0,0|3,0,0]=4 333 B9R1.1 [13CH3]Sc1ccc(nc1)N 62a_200025704644_100000187370 [1,0,0,0,0,0|3,0,0]=4 334 B9R1.6 C=C(C)c1ccccc1 271570a_100000694244_100000210277 [1,0,0,0,0,0|1,0,0]=2 335 B9R1.6 C=C(C)c1ccccn1 271570a_100000694244_100011216584 [1,0,0,0,0,0|2,0,0]=3 336 B9R1.6 C=C(C)c1cccnc1 271570a_100000694244_100000752921 [1,0,0,0,0,0|2,0,0]=3 337 B9R1.6 C=C(C)c1cccnn1 271570a_100000694244_100016991348 [1,0,0,0,0,0|3,0,0]=4 338 B9R1.6 C=C(C)c1ccncc1 271570a_100000694244_100000035832 [1,0,0,0,0,0|2,0,0]=3 339 B9R1.6 C=C(C)c1ccncn1 271570a_100000694244_100000703185 [1,0,0,0,0,0|3,0,0]=4 340 B9R1.6 C=C(C)c1ccnnc1 271570a_100000694244_100000732662 [1,0,0,0,0,0|3,0,0]=4 341 B9R1.6 C=C(C)c1cnccn1 271570a_100000694244_100000758340 [1,0,0,0,0,0|3,0,0]=4 342 B9R1.6 C=C(C)c1cncnc1 271570a_100000694244_100011206942 [1,0,0,0,0,0|3,0,0]=4 343 B9R1.6 C=C(C)c1ncccn1 271570a_100000694244_100000211032 [1,0,0,0,0,0|3,0,0]=4 344 B9R1.6 CC(=O)c1ccccc1 1458a_100000185807_200000210301 [1,0,0,0,0,0|0,0,0]=1 345 B9R1.6 CN(C)c1ccccc1 2230a_100000210012_200000210301 [1,0,0,0,0,0|2,0,0]=3 346 B9R1.6 CN(C)c1ccccc1 269982a_100000210012_200000210301 [1,0,0,0,0,0|2,0,0]=3 347 B9R1.6 CN(C)c1ccccc1 34a_100000210012_200000210301 [1,0,0,0,0,0|2,0,0]=3 348 B9R1.6 CN([13CH3])c1ccccc1 2230a_100000210012_200025704644 [1,0,0,0,0,0|2,0,0]=3 349 B9R1.6 CN([13CH3])c1ccccc1 269982a_100000210012_200025704644 [1,0,0,0,0,0|2,0,0]=3 350 B9R1.6 CN([13CH3])c1ccccc1 34a_100000210012_200025704644 [1,0,0,0,0,0|2,0,0]=3 351 B9R1.6 [13CH3]C(=O)c1ccccc1 1458a_100000185807_200025704644 [1,0,0,0,0,0|0,0,0]=1 352 B11R1.3 C#Cc1ccc(cc1)C(=O)C 1458a_100011217615_200000210301 [0,1,0,0,0,0|0,0,1]=2 353 B11R1.3 C#Cc1ccc(cc1)C(=O)[13CH3] 1458a_100011217615_200025704644 [0,1,0,0,0,0|0,0,1]=2 354 B11R1.3 C=C(C)c1ccc(cc1)C#N 271570a_100000694244_100000179745 [0,1,0,0,0,0|1,0,1]=3 355 B11R1.3 C=C(C)c1ccc(cc1)C=O 271570a_100000694244_100000186029 [0,1,0,0,0,0|1,0,1]=3 356 B11R1.3 C=C(C)c1ccc(cc1)CC 271570a_100000694244_100011215824 [0,1,0,0,0,0|1,0,0]=2 357 B11R1.3 C=C(C)c1ccc(cc1)CF 271570a_100000694244_100010268989 [0,1,0,0,0,0|1,0,0]=2 358 B11R1.3 C=C(C)c1ccc(cc1)CN 271570a_100000694244_100016989417 [0,1,0,0,0,0|1,0,0]=2 359 B11R1.3 C=C(C)c1ccc(cc1)CO 271570a_100000694244_100000690907 [0,1,0,0,0,0|1,0,0]=2 360 B11R1.3 C=C(C)c1ccc(cc1)NC 271570a_100000694244_100000219623 [0,1,0,0,0,0|1,0,0]=2 361 B11R1.3 C=C(C)c1ccc(cc1)NN 271570a_100000694244_100016988836 [0,1,0,0,0,0|2,0,0]=3 362 B11R1.3 C=C(C)c1ccc(cc1)OC 271570a_100000694244_100000171711 [0,1,0,0,0,0|1,0,0]=2 363 B11R1.3 C=C(C)c1ccc(cc1)OC 34a_100009880102_200000210301 [0,1,0,0,0,0|1,0,0]=2 364 B11R1.3 C=C(C)c1ccc(cc1)OC 7a_100009880102_200000210301 [0,1,0,0,0,0|1,0,0]=2 365 B11R1.3 C=C(C)c1ccc(cc1)O[13CH3] 34a_100009880102_200025704644 [0,1,0,0,0,0|1,0,0]=2 366 B11R1.3 C=C(C)c1ccc(cc1)O[13CH3] 7a_100009880102_200025704644 [0,1,0,0,0,0|1,0,0]=2 367 B11R1.3 C=C(C)c1ccc(cc1)SC 271570a_100000694244_100011263217 [0,1,0,0,0,0|1,0,0]=2 368 B11R1.3 C=C(C)c1ccc(cc1)SC 62a_100000185454_200000210301 [0,1,0,0,0,0|1,0,0]=2 369 B11R1.3 C=C(C)c1ccc(cc1)SC 62a_200000210301_100000185454 [0,1,0,0,0,0|1,0,0]=2 370 B11R1.3 C=C(C)c1ccc(cc1)S[13CH3] 62a_100000185454_200025704644 [0,1,0,0,0,0|1,0,0]=2 371 B11R1.3 C=C(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100000185454 [0,1,0,0,0,0|1,0,0]=2 372 B11R1.3 C=C(C)c1ccc(cn1)C#N 271570a_100000694244_100000241038 [0,1,0,0,0,0|2,0,1]=4 373 B11R1.3 C=C(C)c1ccc(cn1)C=O 271570a_100000694244_100000766901 [0,1,0,0,0,0|2,0,1]=4 374 B11R1.3 C=C(C)c1ccc(cn1)CC 271570a_100000694244_100009843584 [0,1,0,0,0,0|2,0,0]=3 375 B11R1.3 C=C(C)c1ccc(cn1)CN 271570a_100000694244_100009817727 [0,1,0,0,0,0|2,0,0]=3 376 B11R1.3 C=C(C)c1ccc(cn1)CO 271570a_100000694244_100009816760 [0,1,0,0,0,0|2,0,0]=3 377 B11R1.3 C=C(C)c1ccc(cn1)NC 271570a_100000694244_100000764248 [0,1,0,0,0,0|2,0,0]=3 378 B11R1.3 C=C(C)c1ccc(cn1)NN 271570a_100000694244_100000119030 [0,1,0,0,0,0|3,0,0]=4 379 B11R1.3 C=C(C)c1ccc(cn1)OC 271570a_100000694244_100000755202 [0,1,0,0,0,0|2,0,0]=3 380 B11R1.3 C=C(C)c1ccc(cn1)SC 271570a_100000694244_100009820866 [0,1,0,0,0,0|2,0,0]=3 381 B11R1.3 C=C(C)c1ccc(nc1)C#N 271570a_100000694244_100000760455 [0,1,0,0,0,0|2,0,1]=4 382 B11R1.3 C=C(C)c1ccc(nc1)C=O 271570a_100000694244_100000754260 [0,1,0,0,0,0|2,0,1]=4 383 B11R1.3 C=C(C)c1ccc(nc1)CC 271570a_100000694244_100009820025 [0,1,0,0,0,0|2,0,0]=3 384 B11R1.3 C=C(C)c1ccc(nc1)CN 271570a_100000694244_100015188789 [0,1,0,0,0,0|2,0,0]=3 385 B11R1.3 C=C(C)c1ccc(nc1)CO 271570a_100000694244_100000754261 [0,1,0,0,0,0|2,0,0]=3 386 B11R1.3 C=C(C)c1ccc(nc1)NC 271570a_100000694244_100000741341 [0,1,0,0,0,0|2,0,0]=3 387 B11R1.3 C=C(C)c1ccc(nc1)NN 271570a_100000694244_100000750576 [0,1,0,0,0,0|3,0,0]=4 388 B11R1.3 C=C(C)c1ccc(nc1)OC 271570a_100000694244_100000047065 [0,1,0,0,0,0|2,0,0]=3 389 B11R1.3 C=C(C)c1ccc(nc1)SC 271570a_100000694244_100011408404 [0,1,0,0,0,0|2,0,0]=3 390 B11R1.3 C=C(C)c1ccc(nn1)NC 271570a_100000694244_100000215272 [0,1,0,0,0,0|3,0,0]=4 391 B11R1.3 C=C(C)c1ccc(nn1)OC 271570a_100000694244_100009819040 [0,1,0,0,0,0|3,0,0]=4 392 B11R1.3 C=C(C)c1cnc(cn1)CO 271570a_100000694244_100012002382 [0,1,0,0,0,0|3,0,0]=4 393 B11R1.3 C=C(C)c1cnc(cn1)NC 271570a_100000694244_100012000640 [0,1,0,0,0,0|3,0,0]=4 394 B11R1.3 C=C(C)c1cnc(cn1)OC 271570a_100000694244_100011998698 [0,1,0,0,0,0|3,0,0]=4 395 B11R1.3 C=C(C)c1cnc(cn1)SC 271570a_100000694244_200012356277 [0,1,0,0,0,0|3,0,0]=4 396 B11R1.3 C=C(C)c1cnc(nc1)CN 271570a_100000694244_200016993442 [0,1,0,0,0,0|3,0,0]=4 397 B11R1.3 C=C(C)c1cnc(nc1)CO 271570a_100000694244_100009867226 [0,1,0,0,0,0|3,0,0]=4 398 B11R1.3 C=C(C)c1cnc(nc1)NC 271570a_100000694244_100000697329 [0,1,0,0,0,0|3,0,0]=4 399 B11R1.3 C=C(C)c1cnc(nc1)OC 271570a_100000694244_100000686852 [0,1,0,0,0,0|3,0,0]=4 400 B11R1.3 C=C(C)c1cnc(nc1)SC 271570a_100000694244_100000722549 [0,1,0,0,0,0|3,0,0]=4 401 B11R1.3 C=C(C)c1ncc(cn1)CC 271570a_100000694244_100000033099 [0,1,0,0,0,0|3,0,0]=4 402 B11R1.3 C=C(C)c1ncc(cn1)CO 271570a_100000694244_100009855073 [0,1,0,0,0,0|3,0,0]=4 403 B11R1.3 C=C(C)c1ncc(cn1)OC 271570a_100000694244_100000069167 [0,1,0,0,0,0|3,0,0]=4 404 B11R1.3 C=C(C)c1ncc(cn1)SC 271570a_100000694244_100000718988 [0,1,0,0,0,0|3,0,0]=4 405 B11R1.3 C=Cc1ccc(cc1)C(=C)C 271570a_100011290941_100000185454 [0,1,0,0,0,0|1,0,1]=3 406 B11R1.3 C=Cc1ccc(cc1)C(=O)C 1458a_100000687532_200000210301 [0,1,0,0,0,0|0,0,1]=2 407 B11R1.3 C=Cc1ccc(cc1)C(=O)C 271570a_100011290941_100000185465 [0,1,0,0,0,0|0,0,1]=2 408 B11R1.3 C=Cc1ccc(cc1)C(=O)N 271570a_100011290941_100000162191 [0,1,0,0,0,0|1,0,1]=3 409 B11R1.3 C=Cc1ccc(cc1)C(=O)[13CH3] 1458a_100000687532_200025704644 [0,1,0,0,0,0|0,0,1]=2 410 B11R1.3 C=Cc1ccc(cc1)C(C)C 271570a_100011290941_100000750031 [0,1,0,0,0,0|1,0,2]=4 411 B11R1.3 C=Cc1ccc(cc1)C(C)O 271570a_100011290941_100000745893 [0,1,0,0,0,0|0,0,3]=4 412 B11R1.3 C=Cc1ccc(cc1)N(C)C 271570a_100011290941_100000210421 [0,1,0,0,0,0|2,0,1]=4 413 B11R1.3 C=Cc1ccc(cc1)S(=O)C 271570a_100011290941_100009816266 [0,1,0,0,0,0|1,0,1]=3 414 B11R1.3 C=Cc1ccc(cc1)[C@@H](C)N 271570a_100011290941_100000720352 [0,1,0,0,0,0|1,0,2]=4 415 B11R1.3 C=Cc1ccc(cc1)[C@H](C)N 271570a_100011290941_100000753911 [0,1,0,0,0,0|1,0,2]=4 416 B11R1.3 C=Cc1ccc(cn1)C(=O)C 271570a_100011290941_100000684857 [0,1,0,0,0,0|1,0,1]=3 417 B11R1.3 C=Cc1ccc(cn1)C(=O)N 271570a_100011290941_100000162237 [0,1,0,0,0,0|2,0,1]=4 418 B11R1.3 C=Cc1ccc(nc1)C(=O)C 271570a_100011290941_100000686046 [0,1,0,0,0,0|1,0,1]=3 419 B11R1.3 C=Cc1ccc(nc1)C(=O)N 271570a_100011290941_100011219284 [0,1,0,0,0,0|2,0,1]=4 420 B11R1.3 C=Cc1cnc(cn1)C(=O)C 271570a_100011290941_100009883172 [0,1,0,0,0,0|2,0,1]=4 421 B11R1.3 C=Cc1cnc(nc1)C(=O)C 271570a_100011290941_100010077182 [0,1,0,0,0,0|2,0,1]=4 422 B11R1.3 C=Cc1ncc(cn1)C(=O)C 271570a_100011290941_100000099681 [0,1,0,0,0,0|2,0,1]=4 423 B11R1.3 CC(=O)c1ccc(cc1)C#N 1458a_100000210717_200000210301 [0,1,0,0,0,0|0,0,1]=2 424 B11R1.3 CC(=O)c1ccc(cc1)CO 1458a_100000183892_200000210301 [0,1,0,0,0,0|0,0,0]=1 425 B11R1.3 CC(=O)c1ccc(cc1)O[13CH3] 34a_100000185113_200025704644 [0,1,0,0,0,0|0,0,0]=1 426 B11R1.3 CC(=O)c1ccc(cc1)O[13CH3] 7a_100000185113_200025704644 [0,1,0,0,0,0|0,0,0]=1 427 B11R1.3 CC(=O)c1ccc(cc1)S[13CH3] 62a_100000185465_200025704644 [0,1,0,0,0,0|0,0,0]=1 428 B11R1.3 CC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000185465 [0,1,0,0,0,0|0,0,0]=1 429 B11R1.3 CC(=O)c1ccc(cn1)O[13CH3] 34a_100012001710_200025704644 [0,1,0,0,0,0|1,0,0]=2 430 B11R1.3 CC(=O)c1ccc(cn1)O[13CH3] 7a_100012001710_200025704644 [0,1,0,0,0,0|1,0,0]=2 431 B11R1.3 CC(=O)c1ccc(cn1)S[13CH3] 62a_100000686046_200025704644 [0,1,0,0,0,0|1,0,0]=2 432 B11R1.3 CC(=O)c1ccc(cn1)S[13CH3] 62a_200025704644_100000686046 [0,1,0,0,0,0|1,0,0]=2 433 B11R1.3 CC(=O)c1ccc(nc1)S[13CH3] 62a_100000684857_200025704644 [0,1,0,0,0,0|1,0,0]=2 434 B11R1.3 CC(=O)c1ccc(nc1)S[13CH3] 62a_200025704644_100000684857 [0,1,0,0,0,0|1,0,0]=2 435 B11R1.3 CC(=O)c1cnc(cn1)S[13CH3] 62a_100009883172_200025704644 [0,1,0,0,0,0|2,0,0]=3 436 B11R1.3 CC(=O)c1cnc(cn1)S[13CH3] 62a_200025704644_100009883172 [0,1,0,0,0,0|2,0,0]=3 437 B11R1.3 CC(=O)c1cnc(nc1)S[13CH3] 62a_100000099681_200025704644 [0,1,0,0,0,0|2,0,0]=3 438 B11R1.3 CC(=O)c1cnc(nc1)S[13CH3] 62a_200025704644_100000099681 [0,1,0,0,0,0|2,0,0]=3 439 B11R1.3 CC(=O)c1ncc(cn1)S[13CH3] 62a_100010077182_200025704644 [0,1,0,0,0,0|2,0,0]=3 440 B11R1.3 CC(=O)c1ncc(cn1)S[13CH3] 62a_200025704644_100010077182 [0,1,0,0,0,0|2,0,0]=3 441 B11R1.3 CC(C)c1ccc(cc1)N[13CH3] 2230a_100000210773_200025704644 [0,1,0,0,0,0|1,0,1]=3 442 B11R1.3 CC(C)c1ccc(cc1)N[13CH3] 34a_100000210773_200025704644 [0,1,0,0,0,0|1,0,1]=3 443 B11R1.3 CC(C)c1ccc(cc1)N[13CH3] 7a_100000210773_200025704644 [0,1,0,0,0,0|1,0,1]=3 444 B11R1.3 CC(C)c1ccc(cc1)O[13CH3] 34a_100000181308_200025704644 [0,1,0,0,0,0|1,0,1]=3 445 B11R1.3 CC(C)c1ccc(cc1)O[13CH3] 7a_100000181308_200025704644 [0,1,0,0,0,0|1,0,1]=3 446 B11R1.3 CC(C)c1ccc(cc1)S[13CH3] 62a_100000750031_200025704644 [0,1,0,0,0,0|1,0,1]=3 447 B11R1.3 CC(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100000750031 [0,1,0,0,0,0|1,0,1]=3 448 B11R1.3 CC(C)c1ccc(cn1)S[13CH3] 62a_100010255768_200025704644 [0,1,0,0,0,0|2,0,1]=4 449 B11R1.3 CC(C)c1ccc(cn1)S[13CH3] 62a_200025704644_100010255768 [0,1,0,0,0,0|2,0,1]=4 450 B11R1.3 CC(C)c1ccc(nc1)S[13CH3] 62a_200009815286_200025704644 [0,1,0,0,0,0|2,0,1]=4 451 B11R1.3 CC(C)c1ccc(nc1)S[13CH3] 62a_200025704644_200009815286 [0,1,0,0,0,0|2,0,1]=4 452 B11R1.3 CC(N)c1ccc(cn1)S[13CH3] 62a_100000723930_200025704644 [0,1,0,0,0,0|2,0,1]=4 453 B11R1.3 CC(N)c1ccc(cn1)S[13CH3] 62a_200025704644_100000723930 [0,1,0,0,0,0|2,0,1]=4 454 B11R1.3 CC(O)c1ccc(cc1)N[13CH3] 2230a_100011216399_200025704644 [0,1,0,0,0,0|0,0,2]=3 455 B11R1.3 CC(O)c1ccc(cc1)N[13CH3] 34a_100011216399_200025704644 [0,1,0,0,0,0|0,0,2]=3 456 B11R1.3 CC(O)c1ccc(cc1)O[13CH3] 34a_100000754508_200025704644 [0,1,0,0,0,0|0,0,2]=3 457 B11R1.3 CC(O)c1ccc(cc1)O[13CH3] 7a_100000754508_200025704644 [0,1,0,0,0,0|0,0,2]=3 458 B11R1.3 CC(O)c1ccc(cc1)S[13CH3] 62a_100000745893_200025704644 [0,1,0,0,0,0|0,0,2]=3 459 B11R1.3 CC(O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000745893 [0,1,0,0,0,0|0,0,2]=3 460 B11R1.3 CC(O)c1ccc(cn1)S[13CH3] 62a_100012353650_200025704644 [0,1,0,0,0,0|1,0,2]=4 461 B11R1.3 CC(O)c1ccc(cn1)S[13CH3] 62a_200025704644_100012353650 [0,1,0,0,0,0|1,0,2]=4 462 B11R1.3 CC(O)c1ccc(nc1)S[13CH3] 62a_200010274204_200025704644 [0,1,0,0,0,0|1,0,2]=4 463 B11R1.3 CC(O)c1ccc(nc1)S[13CH3] 62a_200025704644_200010274204 [0,1,0,0,0,0|1,0,2]=4 464 B11R1.3 CCc1ccc(cc1)C(=O)C 1458a_100000211226_200000210301 [0,1,0,0,0,0|0,0,0]=1 465 B11R1.3 CCc1ccc(cc1)C(=O)[13CH3] 1458a_100000211226_200025704644 [0,1,0,0,0,0|0,0,0]=1 466 B11R1.3 CN(C)c1ccc(cc1)C#N 269982a_100000739737_200000210301 [0,1,0,0,0,0|2,0,1]=4 467 B11R1.3 CN(C)c1ccc(cc1)C#N 34a_100000739737_200000210301 [0,1,0,0,0,0|2,0,1]=4 468 B11R1.3 CN(C)c1ccc(cc1)N[13CH3] 34a_100016997997_200025704644 [0,1,0,0,0,0|2,0,0]=3 469 B11R1.3 CN(C)c1ccc(cc1)O[13CH3] 34a_100000718910_200025704644 [0,1,0,0,0,0|2,0,0]=3 470 B11R1.3 CN(C)c1ccc(cc1)S[13CH3] 62a_100000210421_200025704644 [0,1,0,0,0,0|2,0,0]=3 471 B11R1.3 CN(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100000210421 [0,1,0,0,0,0|2,0,0]=3 472 B11R1.3 CN(C)c1ccc(cn1)S[13CH3] 62a_100011465347_200025704644 [0,1,0,0,0,0|3,0,0]=4 473 B11R1.3 CN(C)c1ccc(cn1)S[13CH3] 62a_200025704644_100011465347 [0,1,0,0,0,0|3,0,0]=4 474 B11R1.3 CN(C)c1ccc(nc1)S[13CH3] 62a_100009992925_200025704644 [0,1,0,0,0,0|3,0,0]=4 475 B11R1.3 CN(C)c1ccc(nc1)S[13CH3] 62a_200025704644_100009992925 [0,1,0,0,0,0|3,0,0]=4 476 B11R1.3 CN([13CH3])c1ccc(cc1)C#N 269982a_100000739737_200025704644 [0,1,0,0,0,0|2,0,1]=4 477 B11R1.3 CN([13CH3])c1ccc(cc1)C#N 34a_100000739737_200025704644 [0,1,0,0,0,0|2,0,1]=4 478 B11R1.3 CNc1ccc(cc1)C(=O)N 27a_100102657272_100000162191 [0,1,0,0,0,0|1,0,0]=2 479 B11R1.3 CNc1ccc(cc1)C(=O)N 34a_100000210537_200000210301 [0,1,0,0,0,0|1,0,0]=2 480 B11R1.3 CNc1ccc(cc1)C(C)C 2230a_100000210773_200000210301 [0,1,0,0,0,0|1,0,1]=3 481 B11R1.3 CNc1ccc(cc1)C(C)C 34a_100000210773_200000210301 [0,1,0,0,0,0|1,0,1]=3 482 B11R1.3 CNc1ccc(cc1)C(C)C 7a_100000210773_200000210301 [0,1,0,0,0,0|1,0,1]=3 483 B11R1.3 CNc1ccc(cc1)C(C)O 2230a_100011216399_200000210301 [0,1,0,0,0,0|0,0,2]=3 484 B11R1.3 CNc1ccc(cc1)C(C)O 34a_100011216399_200000210301 [0,1,0,0,0,0|0,0,2]=3 485 B11R1.3 CNc1ccc(cc1)C(F)F 34a_100020620101_200000210301 [0,1,0,0,0,0|2,0,1]=4 486 B11R1.3 CNc1ccc(cc1)C(F)F 7a_100020620101_200000210301 [0,1,0,0,0,0|2,0,1]=4 487 B11R1.3 CNc1ccc(cc1)N(C)C 34a_100016997997_200000210301 [0,1,0,0,0,0|2,0,0]=3 488 B11R1.3 CNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_200000210301 [0,1,0,0,0,0|2,0,0]=3 489 B11R1.3 CNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_200000210301 [0,1,0,0,0,0|2,0,0]=3 490 B11R1.3 CNc1ccc(cn1)C(=O)C 27a_100102657272_100000690552 [0,1,0,0,0,0|1,0,0]=2 491 B11R1.3 CNc1ccc(cn1)C(=O)N 27a_100102657272_100000162237 [0,1,0,0,0,0|2,0,0]=3 492 B11R1.3 CNc1ccc(nn1)C(=O)N 27a_100102657272_100000761398 [0,1,0,0,0,0|3,0,0]=4 493 B11R1.3 CNc1cnc(cn1)C(=O)C 27a_100102657272_100009883172 [0,1,0,0,0,0|2,0,0]=3 494 B11R1.3 CNc1cnc(cn1)C(=O)N 27a_100102657272_100000738300 [0,1,0,0,0,0|3,0,0]=4 495 B11R1.3 CNc1ncc(cn1)C(=O)C 27a_100102657272_100000099681 [0,1,0,0,0,0|2,0,0]=3 496 B11R1.3 COc1ccc(cc1)C(=O)C 1458a_100000184203_200000210301 [0,1,0,0,0,0|0,0,0]=1 497 B11R1.3 COc1ccc(cc1)C(=O)C 34a_100000185113_200000210301 [0,1,0,0,0,0|0,0,0]=1 498 B11R1.3 COc1ccc(cc1)C(=O)C 7a_100000185113_200000210301 [0,1,0,0,0,0|0,0,0]=1 499 B11R1.3 COc1ccc(cc1)C(=O)N 34a_100000746352_200000210301 [0,1,0,0,0,0|1,0,0]=2 500 B11R1.3 COc1ccc(cc1)C(=O)N 7a_100000746352_200000210301 [0,1,0,0,0,0|1,0,0]=2 501 B11R1.3 COc1ccc(cc1)C(=O)[13CH3] 1458a_100000184203_200025704644 [0,1,0,0,0,0|0,0,0]=1 502 B11R1.3 COc1ccc(cc1)C(C)C 34a_100000181308_200000210301 [0,1,0,0,0,0|1,0,1]=3 503 B11R1.3 COc1ccc(cc1)C(C)C 7a_100000181308_200000210301 [0,1,0,0,0,0|1,0,1]=3 504 B11R1.3 COc1ccc(cc1)C(C)O 34a_100000754508_200000210301 [0,1,0,0,0,0|0,0,2]=3 505 B11R1.3 COc1ccc(cc1)C(C)O 7a_100000754508_200000210301 [0,1,0,0,0,0|0,0,2]=3 506 B11R1.3 COc1ccc(cc1)N(C)C 2230a_100000220023_200000210301 [0,1,0,0,0,0|2,0,0]=3 507 B11R1.3 COc1ccc(cc1)N(C)C 269982a_100000220023_200000210301 [0,1,0,0,0,0|2,0,0]=3 508 B11R1.3 COc1ccc(cc1)N(C)C 34a_100000220023_200000210301 [0,1,0,0,0,0|2,0,0]=3 509 B11R1.3 COc1ccc(cc1)N(C)C 34a_100000718910_200000210301 [0,1,0,0,0,0|2,0,0]=3 510 B11R1.3 COc1ccc(cc1)N(C)[13CH3] 2230a_100000220023_200025704644 [0,1,0,0,0,0|2,0,0]=3 511 B11R1.3 COc1ccc(cc1)N(C)[13CH3] 269982a_100000220023_200025704644 [0,1,0,0,0,0|2,0,0]=3 512 B11R1.3 COc1ccc(cc1)N(C)[13CH3] 34a_100000220023_200025704644 [0,1,0,0,0,0|2,0,0]=3 513 B11R1.3 COc1ccc(cc1)S(=O)C 34a_200000064373_200000210301 [0,1,0,0,0,0|1,0,0]=2 514 B11R1.3 COc1ccc(cc1)S(=O)C 7a_200000064373_200000210301 [0,1,0,0,0,0|1,0,0]=2 515 B11R1.3 COc1ccc(cc1)[C@H](C)N 34a_100161106496_200000210301 [0,1,0,0,0,0|1,0,1]=3 516 B11R1.3 COc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_200000210301 [0,1,0,0,0,0|2,0,0]=3 517 B11R1.3 COc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_200000210301 [0,1,0,0,0,0|2,0,0]=3 518 B11R1.3 COc1ccc(cc1)[S+](C)C 34a_100010188728_200000210301 [0,1,0,0,0,0|2,0,0]=3 519 B11R1.3 COc1ccc(cc1)[S+](C)C 7a_100010188728_200000210301 [0,1,0,0,0,0|2,0,0]=3 520 B11R1.3 COc1ccc(nc1)C(=O)C 34a_100012001710_200000210301 [0,1,0,0,0,0|1,0,0]=2 521 B11R1.3 COc1ccc(nc1)C(=O)C 7a_100012001710_200000210301 [0,1,0,0,0,0|1,0,0]=2 522 B11R1.3 COc1ccc(nc1)[N+](=O)[O-] 7a_100000060138_200000210301 [0,1,0,0,0,0|3,0,0]=4 523 B11R1.3 CS(=O)c1ccc(cc1)O[13CH3] 34a_200000064373_200025704644 [0,1,0,0,0,0|1,0,0]=2 524 B11R1.3 CS(=O)c1ccc(cc1)O[13CH3] 7a_200000064373_200025704644 [0,1,0,0,0,0|1,0,0]=2 525 B11R1.3 CS(=O)c1ccc(cc1)S[13CH3] 62a_100009816266_200025704644 [0,1,0,0,0,0|1,0,0]=2 526 B11R1.3 CS(=O)c1ncc(cn1)S[13CH3] 62a_100010117237_200025704644 [0,1,0,0,0,0|3,0,0]=4 527 B11R1.3 CS(=O)c1ncc(cn1)S[13CH3] 62a_200025704644_100010117237 [0,1,0,0,0,0|3,0,0]=4 528 B11R1.3 CSc1ccc(cc1)B(O)O 62a_100000754493_200000210301 [0,1,0,0,0,0|2,0,1]=4 529 B11R1.3 CSc1ccc(cc1)B(O)O 62a_200000210301_100000754493 [0,1,0,0,0,0|2,0,1]=4 530 B11R1.3 CSc1ccc(cc1)C(=O)C 1458a_100000189692_200000210301 [0,1,0,0,0,0|0,0,0]=1 531 B11R1.3 CSc1ccc(cc1)C(=O)C 62a_100000185465_200000210301 [0,1,0,0,0,0|0,0,0]=1 532 B11R1.3 CSc1ccc(cc1)C(=O)C 62a_200000210301_100000185465 [0,1,0,0,0,0|0,0,0]=1 533 B11R1.3 CSc1ccc(cc1)C(=O)N 62a_100000162191_200000210301 [0,1,0,0,0,0|1,0,0]=2 534 B11R1.3 CSc1ccc(cc1)C(=O)N 62a_200000210301_100000162191 [0,1,0,0,0,0|1,0,0]=2 535 B11R1.3 CSc1ccc(cc1)C(=O)[13CH3] 1458a_100000189692_200025704644 [0,1,0,0,0,0|0,0,0]=1 536 B11R1.3 CSc1ccc(cc1)C(C)C 62a_100000750031_200000210301 [0,1,0,0,0,0|1,0,1]=3 537 B11R1.3 CSc1ccc(cc1)C(C)C 62a_200000210301_100000750031 [0,1,0,0,0,0|1,0,1]=3 538 B11R1.3 CSc1ccc(cc1)C(C)O 62a_100000745893_200000210301 [0,1,0,0,0,0|0,0,2]=3 539 B11R1.3 CSc1ccc(cc1)C(C)O 62a_200000210301_100000745893 [0,1,0,0,0,0|0,0,2]=3 540 B11R1.3 CSc1ccc(cc1)C(F)F 62a_100000687661_200000210301 [0,1,0,0,0,0|2,0,1]=4 541 B11R1.3 CSc1ccc(cc1)C(F)F 62a_200000210301_100000687661 [0,1,0,0,0,0|2,0,1]=4 542 B11R1.3 CSc1ccc(cc1)N(C)C 62a_100000210421_200000210301 [0,1,0,0,0,0|2,0,0]=3 543 B11R1.3 CSc1ccc(cc1)N(C)C 62a_200000210301_100000210421 [0,1,0,0,0,0|2,0,0]=3 544 B11R1.3 CSc1ccc(cc1)S(=O)C 62a_100009816266_200000210301 [0,1,0,0,0,0|1,0,0]=2 545 B11R1.3 CSc1ccc(cc1)[C@@H](C)N 62a_100000720352_200000210301 [0,1,0,0,0,0|1,0,1]=3 546 B11R1.3 CSc1ccc(cc1)[C@@H](C)N 62a_200000210301_100000720352 [0,1,0,0,0,0|1,0,1]=3 547 B11R1.3 CSc1ccc(cc1)[C@H](C)N 62a_100000753911_200000210301 [0,1,0,0,0,0|1,0,1]=3 548 B11R1.3 CSc1ccc(cc1)[C@H](C)N 62a_200000210301_100000753911 [0,1,0,0,0,0|1,0,1]=3 549 B11R1.3 CSc1ccc(cn1)C(=O)C 62a_100000684857_200000210301 [0,1,0,0,0,0|1,0,0]=2 550 B11R1.3 CSc1ccc(cn1)C(=O)C 62a_200000210301_100000684857 [0,1,0,0,0,0|1,0,0]=2 551 B11R1.3 CSc1ccc(cn1)C(=O)N 62a_100000162237_200000210301 [0,1,0,0,0,0|2,0,0]=3 552 B11R1.3 CSc1ccc(cn1)C(=O)N 62a_200000210301_100000162237 [0,1,0,0,0,0|2,0,0]=3 553 B11R1.3 CSc1ccc(cn1)C(C)C 62a_200000210301_200009815286 [0,1,0,0,0,0|2,0,1]=4 554 B11R1.3 CSc1ccc(cn1)C(C)C 62a_200009815286_200000210301 [0,1,0,0,0,0|2,0,1]=4 555 B11R1.3 CSc1ccc(cn1)C(C)O 62a_200000210301_200010274204 [0,1,0,0,0,0|1,0,2]=4 556 B11R1.3 CSc1ccc(cn1)C(C)O 62a_200010274204_200000210301 [0,1,0,0,0,0|1,0,2]=4 557 B11R1.3 CSc1ccc(cn1)N(C)C 62a_100009992925_200000210301 [0,1,0,0,0,0|3,0,0]=4 558 B11R1.3 CSc1ccc(cn1)N(C)C 62a_200000210301_100009992925 [0,1,0,0,0,0|3,0,0]=4 559 B11R1.3 CSc1ccc(cn1)[C@H](C)N 62a_100015387476_200000210301 [0,1,0,0,0,0|2,0,1]=4 560 B11R1.3 CSc1ccc(cn1)[C@H](C)N 62a_200000210301_100015387476 [0,1,0,0,0,0|2,0,1]=4 561 B11R1.3 CSc1ccc(nc1)C(=O)C 62a_100000686046_200000210301 [0,1,0,0,0,0|1,0,0]=2 562 B11R1.3 CSc1ccc(nc1)C(=O)C 62a_200000210301_100000686046 [0,1,0,0,0,0|1,0,0]=2 563 B11R1.3 CSc1ccc(nc1)C(=O)N 62a_100011219284_200000210301 [0,1,0,0,0,0|2,0,0]=3 564 B11R1.3 CSc1ccc(nc1)C(=O)N 62a_200000210301_100011219284 [0,1,0,0,0,0|2,0,0]=3 565 B11R1.3 CSc1ccc(nc1)C(C)C 62a_100010255768_200000210301 [0,1,0,0,0,0|2,0,1]=4 566 B11R1.3 CSc1ccc(nc1)C(C)C 62a_200000210301_100010255768 [0,1,0,0,0,0|2,0,1]=4 567 B11R1.3 CSc1ccc(nc1)C(C)N 62a_100000723930_200000210301 [0,1,0,0,0,0|2,0,1]=4 568 B11R1.3 CSc1ccc(nc1)C(C)N 62a_200000210301_100000723930 [0,1,0,0,0,0|2,0,1]=4 569 B11R1.3 CSc1ccc(nc1)C(C)O 62a_100012353650_200000210301 [0,1,0,0,0,0|1,0,2]=4 570 B11R1.3 CSc1ccc(nc1)C(C)O 62a_200000210301_100012353650 [0,1,0,0,0,0|1,0,2]=4 571 B11R1.3 CSc1ccc(nc1)N(C)C 27a_100102631434_100009820866 [0,1,0,0,0,0|3,0,0]=4 572 B11R1.3 CSc1ccc(nc1)N(C)C 62a_100011465347_200000210301 [0,1,0,0,0,0|3,0,0]=4 573 B11R1.3 CSc1ccc(nc1)N(C)C 62a_200000210301_100011465347 [0,1,0,0,0,0|3,0,0]=4 574 B11R1.3 CSc1ccc(nn1)C(=O)N 62a_100000761398_200000210301 [0,1,0,0,0,0|3,0,0]=4 575 B11R1.3 CSc1ccc(nn1)C(=O)N 62a_200000210301_100000761398 [0,1,0,0,0,0|3,0,0]=4 576 B11R1.3 CSc1cnc(cn1)C(=O)C 62a_100009883172_200000210301 [0,1,0,0,0,0|2,0,0]=3 577 B11R1.3 CSc1cnc(cn1)C(=O)C 62a_200000210301_100009883172 [0,1,0,0,0,0|2,0,0]=3 578 B11R1.3 CSc1cnc(cn1)C(=O)N 62a_100000738300_200000210301 [0,1,0,0,0,0|3,0,0]=4 579 B11R1.3 CSc1cnc(cn1)C(=O)N 62a_200000210301_100000738300 [0,1,0,0,0,0|3,0,0]=4 580 B11R1.3 CSc1cnc(nc1)C(=O)C 62a_100010077182_200000210301 [0,1,0,0,0,0|2,0,0]=3 581 B11R1.3 CSc1cnc(nc1)C(=O)C 62a_200000210301_100010077182 [0,1,0,0,0,0|2,0,0]=3 582 B11R1.3 CSc1cnc(nc1)C(=O)N 62a_100009996756_200000210301 [0,1,0,0,0,0|3,0,0]=4 583 B11R1.3 CSc1cnc(nc1)C(=O)N 62a_200000210301_100009996756 [0,1,0,0,0,0|3,0,0]=4 584 B11R1.3 CSc1cnc(nc1)S(=O)C 62a_100010117237_200000210301 [0,1,0,0,0,0|3,0,0]=4 585 B11R1.3 CSc1cnc(nc1)S(=O)C 62a_200000210301_100010117237 [0,1,0,0,0,0|3,0,0]=4 586 B11R1.3 CSc1ncc(cn1)C(=O)C 62a_100000099681_200000210301 [0,1,0,0,0,0|2,0,0]=3 587 B11R1.3 CSc1ncc(cn1)C(=O)C 62a_200000210301_100000099681 [0,1,0,0,0,0|2,0,0]=3 588 B11R1.3 C[C@@H](N)c1ccc(cc1)S[13CH3] 62a_100000720352_200025704644 [0,1,0,0,0,0|1,0,1]=3 589 B11R1.3 C[C@@H](N)c1ccc(cc1)S[13CH3] 62a_200025704644_100000720352 [0,1,0,0,0,0|1,0,1]=3 590 B11R1.3 C[C@H](N)c1ccc(cc1)O[13CH3] 34a_100161106496_200025704644 [0,1,0,0,0,0|1,0,1]=3 591 B11R1.3 C[C@H](N)c1ccc(cc1)S[13CH3] 62a_100000753911_200025704644 [0,1,0,0,0,0|1,0,1]=3 592 B11R1.3 C[C@H](N)c1ccc(cc1)S[13CH3] 62a_200025704644_100000753911 [0,1,0,0,0,0|1,0,1]=3 593 B11R1.3 C[C@H](N)c1ccc(nc1)S[13CH3] 62a_100015387476_200025704644 [0,1,0,0,0,0|2,0,1]=4 594 B11R1.3 C[C@H](N)c1ccc(nc1)S[13CH3] 62a_200025704644_100015387476 [0,1,0,0,0,0|2,0,1]=4 595 B11R1.3 C[S+](C)c1ccc(cc1)O[13CH3] 34a_100010188728_200025704644 [0,1,0,0,0,0|2,0,0]=3 596 B11R1.3 C[S+](C)c1ccc(cc1)O[13CH3] 7a_100010188728_200025704644 [0,1,0,0,0,0|2,0,0]=3 597 B11R1.3 [13CH3]C(=O)c1ccc(cc1)C#N 1458a_100000210717_200025704644 [0,1,0,0,0,0|0,0,1]=2 598 B11R1.3 [13CH3]C(=O)c1ccc(cc1)CO 1458a_100000183892_200025704644 [0,1,0,0,0,0|0,0,0]=1 599 B11R1.3 [13CH3]Nc1ccc(cc1)C(=O)N 34a_100000210537_200025704644 [0,1,0,0,0,0|1,0,0]=2 600 B11R1.3 [13CH3]Nc1ccc(cc1)C(F)F 34a_100020620101_200025704644 [0,1,0,0,0,0|2,0,1]=4 601 B11R1.3 [13CH3]Nc1ccc(cc1)C(F)F 7a_100020620101_200025704644 [0,1,0,0,0,0|2,0,1]=4 602 B11R1.3 [13CH3]Nc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_200025704644 [0,1,0,0,0,0|2,0,0]=3 603 B11R1.3 [13CH3]Nc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_200025704644 [0,1,0,0,0,0|2,0,0]=3 604 B11R1.3 [13CH3]Oc1ccc(cc1)C(=O)N 34a_100000746352_200025704644 [0,1,0,0,0,0|1,0,0]=2 605 B11R1.3 [13CH3]Oc1ccc(cc1)C(=O)N 7a_100000746352_200025704644 [0,1,0,0,0,0|1,0,0]=2 606 B11R1.3 [13CH3]Oc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_200025704644 [0,1,0,0,0,0|2,0,0]=3 607 B11R1.3 [13CH3]Oc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_200025704644 [0,1,0,0,0,0|2,0,0]=3 608 B11R1.3 [13CH3]Oc1ccc(nc1)[N+](=O)[O-] 7a_100000060138_200025704644 [0,1,0,0,0,0|3,0,0]=4 609 B11R1.3 [13CH3]Sc1ccc(cc1)B(O)O 62a_100000754493_200025704644 [0,1,0,0,0,0|2,0,1]=4 610 B11R1.3 [13CH3]Sc1ccc(cc1)B(O)O 62a_200025704644_100000754493 [0,1,0,0,0,0|2,0,1]=4 611 B11R1.3 [13CH3]Sc1ccc(cc1)C(=O)N 62a_100000162191_200025704644 [0,1,0,0,0,0|1,0,0]=2 612 B11R1.3 [13CH3]Sc1ccc(cc1)C(=O)N 62a_200025704644_100000162191 [0,1,0,0,0,0|1,0,0]=2 613 B11R1.3 [13CH3]Sc1ccc(cc1)C(F)F 62a_100000687661_200025704644 [0,1,0,0,0,0|2,0,1]=4 614 B11R1.3 [13CH3]Sc1ccc(cc1)C(F)F 62a_200025704644_100000687661 [0,1,0,0,0,0|2,0,1]=4 615 B11R1.3 [13CH3]Sc1ccc(cn1)C(=O)N 62a_100000162237_200025704644 [0,1,0,0,0,0|2,0,0]=3 616 B11R1.3 [13CH3]Sc1ccc(cn1)C(=O)N 62a_200025704644_100000162237 [0,1,0,0,0,0|2,0,0]=3 617 B11R1.3 [13CH3]Sc1ccc(nc1)C(=O)N 62a_100011219284_200025704644 [0,1,0,0,0,0|2,0,0]=3 618 B11R1.3 [13CH3]Sc1ccc(nc1)C(=O)N 62a_200025704644_100011219284 [0,1,0,0,0,0|2,0,0]=3 619 B11R1.3 [13CH3]Sc1ccc(nn1)C(=O)N 62a_100000761398_200025704644 [0,1,0,0,0,0|3,0,0]=4 620 B11R1.3 [13CH3]Sc1ccc(nn1)C(=O)N 62a_200025704644_100000761398 [0,1,0,0,0,0|3,0,0]=4 621 B11R1.3 [13CH3]Sc1cnc(cn1)C(=O)N 62a_100000738300_200025704644 [0,1,0,0,0,0|3,0,0]=4 622 B11R1.3 [13CH3]Sc1cnc(cn1)C(=O)N 62a_200025704644_100000738300 [0,1,0,0,0,0|3,0,0]=4 623 B11R1.3 [13CH3]Sc1cnc(nc1)C(=O)N 62a_100009996756_200025704644 [0,1,0,0,0,0|3,0,0]=4 624 B11R1.3 [13CH3]Sc1cnc(nc1)C(=O)N 62a_200025704644_100009996756 [0,1,0,0,0,0|3,0,0]=4 625 B11R1.19 CC(C)(C)c1ccc(cc1)O 271570a_203496583355_100011215385 [0,1,0,0,0,0|2,0,1]=4 626 B11R1.19 CC(C)(N)c1ccc(cc1)O 271570a_203496583355_100000739617 [0,1,0,0,0,0|2,0,1]=4 627 B11R1.19 CC(C)(O)c1ccc(cc1)O 271570a_203496583355_100000753367 [0,1,0,0,0,0|1,0,2]=4 628 B11R1.19 CC(F)(F)c1ccc(cc1)O 271570a_203496583355_100009817129 [0,1,0,0,0,0|2,0,1]=4 629 B11R1.19 CS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000765142 [0,1,0,0,0,0|2,0,0]=3 630 B11R1.19 CS(=O)(=O)c1ccc(cn1)O 271570a_203496583355_100009814649 [0,1,0,0,0,0|3,0,0]=4 631 B11R1.19 CS(=O)(=O)c1ccc(nc1)O 271570a_203496583355_100009816761 [0,1,0,0,0,0|3,0,0]=4 632 B11R1.19 C[Si](C)(C)c1ccc(cc1)O 271570a_203496583355_100009813420 [0,1,0,0,0,0|2,1,0]=4 633 B11R1.19 NS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000701559 [0,1,0,0,0,0|3,0,0]=4 634 B11R1.21 C=C(C)c1c[nH]c(=O)c(c1)Br 271570a_100000694244_100010125443 [0,1,0,0,0,0|3,0,0]=4 635 B11R1.21 C=C(C)c1c[nH]c(=O)c(c1)F 271570a_100000694244_100000723523 [0,1,0,0,0,0|3,0,0]=4 636 B11R1.21 C=C(C)c1c[nH]c(=O)c(c1)O 271570a_100000694244_100009814561 [0,1,0,0,0,0|3,0,0]=4 637 B11R1.21 C=C(C)c1cc(=O)n(cn1)C 271570a_100000694244_100012179353 [0,1,0,0,0,0|3,0,0]=4 638 B11R1.21 C=C(C)c1cc(c(cn1)Br)C 271570a_100000694244_100012356354 [0,1,0,0,0,0|3,0,0]=4 639 B11R1.21 C=C(C)c1cc(c(cn1)C)C 271570a_100000694244_100009850809 [0,1,0,0,0,0|2,0,0]=3 640 B11R1.21 C=C(C)c1cc(c(cn1)C)F 271570a_100000694244_100009841206 [0,1,0,0,0,0|2,0,0]=3 641 B11R1.21 C=C(C)c1cc(c(cn1)C)N 271570a_100000694244_100000690170 [0,1,0,0,0,0|2,0,0]=3 642 B11R1.21 C=C(C)c1cc(c(cn1)C)O 271570a_100000694244_100000704368 [0,1,0,0,0,0|2,0,0]=3 643 B11R1.21 C=C(C)c1cc(c(cn1)F)C 271570a_100000694244_100009818257 [0,1,0,0,0,0|3,0,0]=4 644 B11R1.21 C=C(C)c1cc(c(cn1)F)N 271570a_100000694244_100000126464 [0,1,0,0,0,0|3,0,0]=4 645 B11R1.21 C=C(C)c1cc(c(cn1)F)O 271570a_100000694244_100009854642 [0,1,0,0,0,0|3,0,0]=4 646 B11R1.21 C=C(C)c1cc(c(cn1)N)C 271570a_100000694244_100000765520 [0,1,0,0,0,0|3,0,0]=4 647 B11R1.21 C=C(C)c1cc(c(cn1)N)N 271570a_100000694244_100000067514 [0,1,0,0,0,0|3,0,0]=4 648 B11R1.21 C=C(C)c1cc(c(cn1)O)C 271570a_100000694244_100000692680 [0,1,0,0,0,0|3,0,0]=4 649 B11R1.21 C=C(C)c1cc(c(cn1)O)N 271570a_100000694244_100009819941 [0,1,0,0,0,0|3,0,0]=4 650 B11R1.21 C=C(C)c1ccc(=O)n(c1)C 271570a_100000694244_100011245003 [0,1,0,0,0,0|3,0,0]=4 651 B11R1.21 C=C(C)c1ccc([n+](c1)[O-])C 271570a_100000694244_100000703231 [0,1,0,0,0,0|2,0,0]=3 652 B11R1.21 C=C(C)c1ccc(c(=S)[nH]1)N 271570a_100000694244_100116329207 [0,1,0,0,0,0|3,0,0]=4 653 B11R1.21 C=C(C)c1ccc(c(c1)Br)Br 271570a_100000694244_100012356285 [0,1,0,0,0,0|2,0,0]=3 654 B11R1.21 C=C(C)c1ccc(c(c1)Br)C 271570a_100000694244_100011847877 [0,1,0,0,0,0|1,0,0]=2 655 B11R1.21 C=C(C)c1ccc(c(c1)Br)Cl 271570a_100000694244_100012353702 [0,1,0,0,0,0|2,0,0]=3 656 B11R1.21 C=C(C)c1ccc(c(c1)Br)F 271570a_100000694244_100012047266 [0,1,0,0,0,0|2,0,0]=3 657 B11R1.21 C=C(C)c1ccc(c(c1)Br)N 271570a_100000694244_100000750455 [0,1,0,0,0,0|2,0,0]=3 658 B11R1.21 C=C(C)c1ccc(c(c1)Br)O 271570a_100000694244_100012361655 [0,1,0,0,0,0|2,0,0]=3 659 B11R1.21 C=C(C)c1ccc(c(c1)C)Br 271570a_100000694244_100009813585 [0,1,0,0,0,0|2,0,0]=3 660 B11R1.21 C=C(C)c1ccc(c(c1)C)C 271570a_100000694244_100011215607 [0,1,0,0,0,0|1,0,0]=2 661 B11R1.21 C=C(C)c1ccc(c(c1)C)Cl 271570a_100000694244_100000049509 [0,1,0,0,0,0|2,0,0]=3 662 B11R1.21 C=C(C)c1ccc(c(c1)C)F 271570a_100000694244_100011218330 [0,1,0,0,0,0|2,0,0]=3 663 B11R1.21 C=C(C)c1ccc(c(c1)C)N 271570a_100000694244_100000211769 [0,1,0,0,0,0|2,0,0]=3 664 B11R1.21 C=C(C)c1ccc(c(c1)C)O 271570a_100000694244_100000186361 [0,1,0,0,0,0|2,0,0]=3 665 B11R1.21 C=C(C)c1ccc(c(c1)Cl)Br 271570a_100000694244_100012047281 [0,1,0,0,0,0|2,0,0]=3 666 B11R1.21 C=C(C)c1ccc(c(c1)Cl)C 271570a_100000694244_100011216363 [0,1,0,0,0,0|1,0,0]=2 667 B11R1.21 C=C(C)c1ccc(c(c1)Cl)Cl 271570a_100000694244_100011214914 [0,1,0,0,0,0|2,0,0]=3 668 B11R1.21 C=C(C)c1ccc(c(c1)Cl)F 271570a_100000694244_100011215976 [0,1,0,0,0,0|2,0,0]=3 669 B11R1.21 C=C(C)c1ccc(c(c1)Cl)N 271570a_100000694244_100011218065 [0,1,0,0,0,0|2,0,0]=3 670 B11R1.21 C=C(C)c1ccc(c(c1)Cl)O 271570a_100000694244_100012360047 [0,1,0,0,0,0|2,0,0]=3 671 B11R1.21 C=C(C)c1ccc(c(c1)F)Br 271570a_100000694244_100000685389 [0,1,0,0,0,0|2,0,0]=3 672 B11R1.21 C=C(C)c1ccc(c(c1)F)C 271570a_100000694244_100000720648 [0,1,0,0,0,0|1,0,0]=2 673 B11R1.21 C=C(C)c1ccc(c(c1)F)Cl 271570a_100000694244_100011216805 [0,1,0,0,0,0|2,0,0]=3 674 B11R1.21 C=C(C)c1ccc(c(c1)F)F 271570a_100000694244_100000750028 [0,1,0,0,0,0|2,0,0]=3 675 B11R1.21 C=C(C)c1ccc(c(c1)F)N 271570a_100000694244_100011215594 [0,1,0,0,0,0|2,0,0]=3 676 B11R1.21 C=C(C)c1ccc(c(c1)F)O 271570a_100000694244_100000185481 [0,1,0,0,0,0|2,0,0]=3 677 B11R1.21 C=C(C)c1ccc(c(c1)N)Br 271570a_100000694244_100000750456 [0,1,0,0,0,0|2,0,0]=3 678 B11R1.21 C=C(C)c1ccc(c(c1)N)C 271570a_100000694244_100000761890 [0,1,0,0,0,0|1,0,0]=2 679 B11R1.21 C=C(C)c1ccc(c(c1)N)Cl 271570a_100000694244_200000761891 [0,1,0,0,0,0|2,0,0]=3 680 B11R1.21 C=C(C)c1ccc(c(c1)N)F 271570a_100000694244_100000740924 [0,1,0,0,0,0|2,0,0]=3 681 B11R1.21 C=C(C)c1ccc(c(c1)N)N 271570a_100000694244_100000741789 [0,1,0,0,0,0|2,0,0]=3 682 B11R1.21 C=C(C)c1ccc(c(c1)N)O 271570a_100000694244_100000752626 [0,1,0,0,0,0|2,0,0]=3 683 B11R1.21 C=C(C)c1ccc(c(c1)O)Br 271570a_100000694244_100012356990 [0,1,0,0,0,0|2,0,0]=3 684 B11R1.21 C=C(C)c1ccc(c(c1)O)C 271570a_100000694244_100000766334 [0,1,0,0,0,0|1,0,0]=2 685 B11R1.21 C=C(C)c1ccc(c(c1)O)Cl 271570a_100000694244_100011356854 [0,1,0,0,0,0|2,0,0]=3 686 B11R1.21 C=C(C)c1ccc(c(c1)O)F 271570a_100000694244_100000686035 [0,1,0,0,0,0|2,0,0]=3 687 B11R1.21 C=C(C)c1ccc(c(c1)O)N 271570a_100000694244_100000739049 [0,1,0,0,0,0|2,0,0]=3 688 B11R1.21 C=C(C)c1ccc(c(c1)O)O 271570a_100000694244_100009813601 [0,1,0,0,0,0|2,0,0]=3 689 B11R1.21 C=C(C)c1ccc(c(n1)Br)O 271570a_100000694244_100000725334 [0,1,0,0,0,0|3,0,0]=4 690 B11R1.21 C=C(C)c1ccc(c(n1)C)Br 271570a_100000694244_100012360386 [0,1,0,0,0,0|3,0,0]=4 691 B11R1.21 C=C(C)c1ccc(c(n1)C)C 271570a_100000694244_100000103781 [0,1,0,0,0,0|2,0,0]=3 692 B11R1.21 C=C(C)c1ccc(c(n1)C)F 271570a_100000694244_100009814307 [0,1,0,0,0,0|3,0,0]=4 693 B11R1.21 C=C(C)c1ccc(c(n1)C)N 271570a_100000694244_100000760127 [0,1,0,0,0,0|3,0,0]=4 694 B11R1.21 C=C(C)c1ccc(c(n1)C)O 271570a_100000694244_100010233687 [0,1,0,0,0,0|3,0,0]=4 695 B11R1.21 C=C(C)c1ccc(c(n1)Cl)N 271570a_100000694244_200010233646 [0,1,0,0,0,0|3,0,0]=4 696 B11R1.21 C=C(C)c1ccc(c(n1)Cl)O 271570a_100000694244_100000721234 [0,1,0,0,0,0|3,0,0]=4 697 B11R1.21 C=C(C)c1ccc(c(n1)F)Br 271570a_100000694244_100010134343 [0,1,0,0,0,0|3,0,0]=4 698 B11R1.21 C=C(C)c1ccc(c(n1)F)N 271570a_100000694244_100009856439 [0,1,0,0,0,0|3,0,0]=4 699 B11R1.21 C=C(C)c1ccc(c(n1)F)O 271570a_100000694244_100009819667 [0,1,0,0,0,0|3,0,0]=4 700 B11R1.21 C=C(C)c1ccc(c(n1)N)C 271570a_100000694244_100009857032 [0,1,0,0,0,0|2,0,0]=3 701 B11R1.21 C=C(C)c1ccc(c(n1)N)F 271570a_100000694244_100016091773 [0,1,0,0,0,0|3,0,0]=4 702 B11R1.21 C=C(C)c1ccc(c(n1)N)N 271570a_100000694244_100000747239 [0,1,0,0,0,0|3,0,0]=4 703 B11R1.21 C=C(C)c1ccc(c(n1)N)O 271570a_100000694244_100000685527 [0,1,0,0,0,0|3,0,0]=4 704 B11R1.21 C=C(C)c1ccc(c(n1)O)F 271570a_100000694244_100010729010 [0,1,0,0,0,0|3,0,0]=4 705 B11R1.21 C=C(C)c1ccc(c(n1)O)N 271570a_100000694244_100000718904 [0,1,0,0,0,0|3,0,0]=4 706 B11R1.21 C=C(C)c1ccn(c(=O)c1)C 271570a_100000694244_100009820031 [0,1,0,0,0,0|2,0,0]=3 707 B11R1.21 C=C(C)c1cnc(c(c1)Br)Cl 271570a_100000694244_100010172733 [0,1,0,0,0,0|3,0,0]=4 708 B11R1.21 C=C(C)c1cnc(c(c1)Br)N 271570a_100000694244_100012353989 [0,1,0,0,0,0|3,0,0]=4 709 B11R1.21 C=C(C)c1cnc(c(c1)C)Br 271570a_100000694244_100009816107 [0,1,0,0,0,0|3,0,0]=4 710 B11R1.21 C=C(C)c1cnc(c(c1)C)C 271570a_100000694244_100000697892 [0,1,0,0,0,0|2,0,0]=3 711 B11R1.21 C=C(C)c1cnc(c(c1)C)Cl 271570a_100000694244_100009922867 [0,1,0,0,0,0|3,0,0]=4 712 B11R1.21 C=C(C)c1cnc(c(c1)C)F 271570a_100000694244_100000709442 [0,1,0,0,0,0|3,0,0]=4 713 B11R1.21 C=C(C)c1cnc(c(c1)C)N 271570a_100000694244_100000186686 [0,1,0,0,0,0|3,0,0]=4 714 B11R1.21 C=C(C)c1cnc(c(c1)C)O 271570a_100000694244_100000685391 [0,1,0,0,0,0|3,0,0]=4 715 B11R1.21 C=C(C)c1cnc(c(c1)Cl)N 271570a_100000694244_100012356299 [0,1,0,0,0,0|3,0,0]=4 716 B11R1.21 C=C(C)c1cnc(c(c1)Cl)O 271570a_100000694244_100010238531 [0,1,0,0,0,0|3,0,0]=4 717 B11R1.21 C=C(C)c1cnc(c(c1)F)C 271570a_100000694244_100009845756 [0,1,0,0,0,0|2,0,0]=3 718 B11R1.21 C=C(C)c1cnc(c(c1)F)F 271570a_100000694244_100009817721 [0,1,0,0,0,0|3,0,0]=4 719 B11R1.21 C=C(C)c1cnc(c(c1)F)N 271570a_100000694244_100000693161 [0,1,0,0,0,0|3,0,0]=4 720 B11R1.21 C=C(C)c1cnc(c(c1)N)C 271570a_100000694244_100011999542 [0,1,0,0,0,0|2,0,0]=3 721 B11R1.21 C=C(C)c1cnc(c(c1)N)Cl 271570a_100000694244_100009828400 [0,1,0,0,0,0|3,0,0]=4 722 B11R1.21 C=C(C)c1cnc(c(c1)N)F 271570a_100000694244_100009816798 [0,1,0,0,0,0|3,0,0]=4 723 B11R1.21 C=C(C)c1cnc(c(c1)N)N 271570a_100000694244_100000184470 [0,1,0,0,0,0|3,0,0]=4 724 B11R1.21 C=C(C)c1cnc(c(c1)N)O 271570a_100000694244_100000743729 [0,1,0,0,0,0|3,0,0]=4 725 B11R1.21 C=C(C)c1cnc(c(c1)O)C 271570a_100000694244_100009864810 [0,1,0,0,0,0|2,0,0]=3 726 B11R1.21 C=C(C)c1cnc(c(c1)O)F 271570a_100000694244_100009819871 [0,1,0,0,0,0|3,0,0]=4 727 B11R1.21 C=C(C)c1cnc(c(c1)O)N 271570a_100000694244_100009819042 [0,1,0,0,0,0|3,0,0]=4 728 B11R1.21 C=C(C)c1cnc(c(n1)C)C 271570a_100000694244_100009878948 [0,1,0,0,0,0|3,0,0]=4 729 B11R1.21 C=C(C)c1cnn(c(=O)c1)C 271570a_100000694244_200010986246 [0,1,0,0,0,0|3,0,0]=4 730 B11R1.21 C=C(C)c1ncc(c(n1)N)C 271570a_100000694244_100011996698 [0,1,0,0,0,0|3,0,0]=4 731 B11R1.21 CC(=O)c1cc(c(cn1)O)C 271570a_203496583355_100011011822 [0,1,0,0,0,0|2,0,0]=3 732 B11R1.21 CC(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_200000210301 [0,1,0,0,0,0|1,0,0]=2 733 B11R1.21 CC(=O)c1ccc(c(c1)Br)C 1458a_100000186397_200000210301 [0,1,0,0,0,0|0,0,0]=1 734 B11R1.21 CC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_200000210301 [0,1,0,0,0,0|1,0,0]=2 735 B11R1.21 CC(=O)c1ccc(c(c1)Br)F 1458a_100000760357_200000210301 [0,1,0,0,0,0|1,0,0]=2 736 B11R1.21 CC(=O)c1ccc(c(c1)Br)I 1458a_100000739115_200000210301 [0,1,0,0,0,0|1,0,0]=2 737 B11R1.21 CC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_200000210301 [0,1,0,0,0,0|1,0,0]=2 738 B11R1.21 CC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100010146554 [0,1,0,0,0,0|1,0,0]=2 739 B11R1.21 CC(=O)c1ccc(c(c1)C)Br 1458a_100000692631_200000210301 [0,1,0,0,0,0|1,0,0]=2 740 B11R1.21 CC(=O)c1ccc(c(c1)C)C 1458a_100000210898_200000210301 [0,1,0,0,0,0|0,0,0]=1 741 B11R1.21 CC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_200000210301 [0,1,0,0,0,0|1,0,0]=2 742 B11R1.21 CC(=O)c1ccc(c(c1)C)F 1458a_100000751819_200000210301 [0,1,0,0,0,0|1,0,0]=2 743 B11R1.21 CC(=O)c1ccc(c(c1)C)I 1458a_100000751300_200000210301 [0,1,0,0,0,0|1,0,0]=2 744 B11R1.21 CC(=O)c1ccc(c(c1)C)O 1458a_100000685612_200000210301 [0,1,0,0,0,0|1,0,0]=2 745 B11R1.21 CC(=O)c1ccc(c(c1)C)O 271570a_203496583355_100000697869 [0,1,0,0,0,0|1,0,0]=2 746 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_200000210301 [0,1,0,0,0,0|1,0,0]=2 747 B11R1.21 CC(=O)c1ccc(c(c1)Cl)C 1458a_100000751740_200000210301 [0,1,0,0,0,0|0,0,0]=1 748 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_200000210301 [0,1,0,0,0,0|1,0,0]=2 749 B11R1.21 CC(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_200000210301 [0,1,0,0,0,0|1,0,0]=2 750 B11R1.21 CC(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_200000210301 [0,1,0,0,0,0|1,0,0]=2 751 B11R1.21 CC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_200000210301 [0,1,0,0,0,0|1,0,0]=2 752 B11R1.21 CC(=O)c1ccc(c(c1)F)Br 1458a_100000743946_200000210301 [0,1,0,0,0,0|1,0,0]=2 753 B11R1.21 CC(=O)c1ccc(c(c1)F)C 1458a_100000212313_200000210301 [0,1,0,0,0,0|0,0,0]=1 754 B11R1.21 CC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_200000210301 [0,1,0,0,0,0|1,0,0]=2 755 B11R1.21 CC(=O)c1ccc(c(c1)F)F 1458a_100000209822_200000210301 [0,1,0,0,0,0|1,0,0]=2 756 B11R1.21 CC(=O)c1ccc(c(c1)F)I 1458a_100000062624_200000210301 [0,1,0,0,0,0|1,0,0]=2 757 B11R1.21 CC(=O)c1ccc(c(c1)F)O 1458a_100000185466_200000210301 [0,1,0,0,0,0|1,0,0]=2 758 B11R1.21 CC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100000690002 [0,1,0,0,0,0|1,0,0]=2 759 B11R1.21 CC(=O)c1ccc(c(c1)I)Br 1458a_100012343876_200000210301 [0,1,0,0,0,0|1,0,0]=2 760 B11R1.21 CC(=O)c1ccc(c(c1)I)C 1458a_100000751299_200000210301 [0,1,0,0,0,0|0,0,0]=1 761 B11R1.21 CC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_200000210301 [0,1,0,0,0,0|1,0,0]=2 762 B11R1.21 CC(=O)c1ccc(c(c1)I)F 1458a_100000688015_200000210301 [0,1,0,0,0,0|1,0,0]=2 763 B11R1.21 CC(=O)c1ccc(c(c1)I)I 1458a_100000725830_200000210301 [0,1,0,0,0,0|1,0,0]=2 764 B11R1.21 CC(=O)c1ccc(c(c1)I)O 1458a_100000037485_200000210301 [0,1,0,0,0,0|1,0,0]=2 765 B11R1.21 CC(=O)c1ccc(c(c1)N)O 271570a_203496583355_100009816534 [0,1,0,0,0,0|1,0,0]=2 766 B11R1.21 CC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_200000210301 [0,1,0,0,0,0|1,0,0]=2 767 B11R1.21 CC(=O)c1ccc(c(c1)O)Br 271570a_203496583355_100010146556 [0,1,0,0,0,0|1,0,0]=2 768 B11R1.21 CC(=O)c1ccc(c(c1)O)C 1458a_100000233767_200000210301 [0,1,0,0,0,0|0,0,0]=1 769 B11R1.21 CC(=O)c1ccc(c(c1)O)C 271570a_203496583355_100011934287 [0,1,0,0,0,0|0,0,0]=1 770 B11R1.21 CC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_200000210301 [0,1,0,0,0,0|1,0,0]=2 771 B11R1.21 CC(=O)c1ccc(c(c1)O)F 1458a_100000035894_200000210301 [0,1,0,0,0,0|1,0,0]=2 772 B11R1.21 CC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100000239719 [0,1,0,0,0,0|1,0,0]=2 773 B11R1.21 CC(=O)c1ccc(c(c1)O)I 1458a_100000239334_200000210301 [0,1,0,0,0,0|1,0,0]=2 774 B11R1.21 CC(=O)c1ccc(c(c1)O)N 271570a_203496583355_100012029215 [0,1,0,0,0,0|1,0,0]=2 775 B11R1.21 CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_200000210301 [0,1,0,0,0,0|1,0,0]=2 776 B11R1.21 CC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100011772453 [0,1,0,0,0,0|1,0,0]=2 777 B11R1.21 CC(=O)c1cnc(c(c1)C)O 271570a_203496583355_100009864263 [0,1,0,0,0,0|2,0,0]=3 778 B11R1.21 CC(=O)c1cnc(c(c1)O)F 271570a_203496583355_200010135287 [0,1,0,0,0,0|2,0,0]=3 779 B11R1.21 CC(C)c1ccc(c(c1)Br)O 271570a_203496583355_200010212211 [0,1,0,0,0,0|2,0,1]=4 780 B11R1.21 CC(C)c1ccc(c(c1)O)N 271570a_203496583355_100011218581 [0,1,0,0,0,0|2,0,1]=4 781 B11R1.21 CC(O)c1ccc(c(c1)O)F 271570a_203496583355_100011191524 [0,1,0,0,0,0|1,0,2]=4 782 B11R1.21 CN(C)c1ccc(c(c1)Cl)Cl 2230a_100000219944_200000210301 [0,1,0,0,0,0|3,0,0]=4 783 B11R1.21 CN(C)c1ccc(c(c1)Cl)Cl 269982a_100000219944_200000210301 [0,1,0,0,0,0|3,0,0]=4 784 B11R1.21 CN(C)c1ccc(c(c1)Cl)Cl 34a_100000219944_200000210301 [0,1,0,0,0,0|3,0,0]=4 785 B11R1.21 CN(C)c1ccc(c(c1)Cl)F 2230a_100000697440_200000210301 [0,1,0,0,0,0|3,0,0]=4 786 B11R1.21 CN(C)c1ccc(c(c1)Cl)F 269982a_100000697440_200000210301 [0,1,0,0,0,0|3,0,0]=4 787 B11R1.21 CN(C)c1ccc(c(c1)Cl)F 34a_100000697440_200000210301 [0,1,0,0,0,0|3,0,0]=4 788 B11R1.21 CN(C)c1ccc(c(c1)Cl)F 38a_100000697440_200000210301 [0,1,0,0,0,0|3,0,0]=4 789 B11R1.21 CN(C)c1ccc(c(c1)Cl)F 7a_100000697440_200000210301 [0,1,0,0,0,0|3,0,0]=4 790 B11R1.21 CN(C)c1ccc(c(c1)F)Br 2230a_100012285320_200000210301 [0,1,0,0,0,0|3,0,0]=4 791 B11R1.21 CN(C)c1ccc(c(c1)F)Br 269982a_100012285320_200000210301 [0,1,0,0,0,0|3,0,0]=4 792 B11R1.21 CN(C)c1ccc(c(c1)F)Br 34a_100012285320_200000210301 [0,1,0,0,0,0|3,0,0]=4 793 B11R1.21 CN(C)c1ccc(c(c1)F)Br 7a_100012285320_200000210301 [0,1,0,0,0,0|3,0,0]=4 794 B11R1.21 CN(C)c1ccc(c(c1)F)F 2230a_100000221014_200000210301 [0,1,0,0,0,0|3,0,0]=4 795 B11R1.21 CN(C)c1ccc(c(c1)F)F 269982a_100000221014_200000210301 [0,1,0,0,0,0|3,0,0]=4 796 B11R1.21 CN(C)c1ccc(c(c1)F)F 34a_100000221014_200000210301 [0,1,0,0,0,0|3,0,0]=4 797 B11R1.21 CN(C)c1ccc(c(c1)F)F 38a_100000221014_200000210301 [0,1,0,0,0,0|3,0,0]=4 798 B11R1.21 CN(C)c1ccc(c(c1)F)F 7a_100000221014_200000210301 [0,1,0,0,0,0|3,0,0]=4 799 B11R1.21 CN(C)c1ccc(c(c1)O)N 271570a_203496583355_200013039233 [0,1,0,0,0,0|3,0,0]=4 800 B11R1.21 CN(C)c1ccn(c(=O)c1)C 27a_100102631434_100009820031 [0,1,0,0,0,0|3,0,0]=4 801 B11R1.21 CN([13CH3])c1ccc(c(c1)Cl)Cl 2230a_100000219944_200025704644 [0,1,0,0,0,0|3,0,0]=4 802 B11R1.21 CN([13CH3])c1ccc(c(c1)Cl)Cl 269982a_100000219944_200025704644 [0,1,0,0,0,0|3,0,0]=4 803 B11R1.21 CN([13CH3])c1ccc(c(c1)Cl)Cl 34a_100000219944_200025704644 [0,1,0,0,0,0|3,0,0]=4 804 B11R1.21 CN([13CH3])c1ccc(c(c1)Cl)F 2230a_100000697440_200025704644 [0,1,0,0,0,0|3,0,0]=4 805 B11R1.21 CN([13CH3])c1ccc(c(c1)Cl)F 269982a_100000697440_200025704644 [0,1,0,0,0,0|3,0,0]=4 806 B11R1.21 CN([13CH3])c1ccc(c(c1)Cl)F 34a_100000697440_200025704644 [0,1,0,0,0,0|3,0,0]=4 807 B11R1.21 CN([13CH3])c1ccc(c(c1)Cl)F 38a_100000697440_200025704644 [0,1,0,0,0,0|3,0,0]=4 808 B11R1.21 CN([13CH3])c1ccc(c(c1)Cl)F 7a_100000697440_200025704644 [0,1,0,0,0,0|3,0,0]=4 809 B11R1.21 CN([13CH3])c1ccc(c(c1)F)Br 2230a_100012285320_200025704644 [0,1,0,0,0,0|3,0,0]=4 810 B11R1.21 CN([13CH3])c1ccc(c(c1)F)Br 269982a_100012285320_200025704644 [0,1,0,0,0,0|3,0,0]=4 811 B11R1.21 CN([13CH3])c1ccc(c(c1)F)Br 34a_100012285320_200025704644 [0,1,0,0,0,0|3,0,0]=4 812 B11R1.21 CN([13CH3])c1ccc(c(c1)F)Br 7a_100012285320_200025704644 [0,1,0,0,0,0|3,0,0]=4 813 B11R1.21 CN([13CH3])c1ccc(c(c1)F)F 2230a_100000221014_200025704644 [0,1,0,0,0,0|3,0,0]=4 814 B11R1.21 CN([13CH3])c1ccc(c(c1)F)F 269982a_100000221014_200025704644 [0,1,0,0,0,0|3,0,0]=4 815 B11R1.21 CN([13CH3])c1ccc(c(c1)F)F 34a_100000221014_200025704644 [0,1,0,0,0,0|3,0,0]=4 816 B11R1.21 CN([13CH3])c1ccc(c(c1)F)F 38a_100000221014_200025704644 [0,1,0,0,0,0|3,0,0]=4 817 B11R1.21 CN([13CH3])c1ccc(c(c1)F)F 7a_100000221014_200025704644 [0,1,0,0,0,0|3,0,0]=4 818 B11R1.21 C[C@H](N)c1ccc(c(c1)F)O 271570a_203496583355_100134618348 [0,1,0,0,0,0|2,0,1]=4 819 B11R1.21 C[C@H](N)c1ccc(c(c1)O)F 271570a_203496583355_100000753309 [0,1,0,0,0,0|2,0,1]=4 820 B11R1.21 Cc1cc(ccc1Br)C(=O)[13CH3] 1458a_100000692631_200025704644 [0,1,0,0,0,0|1,0,0]=2 821 B11R1.21 Cc1cc(ccc1Br)N(C)C 2230a_100102888905_200000210301 [0,1,0,0,0,0|3,0,0]=4 822 B11R1.21 Cc1cc(ccc1Br)N(C)C 269982a_100102888905_200000210301 [0,1,0,0,0,0|3,0,0]=4 823 B11R1.21 Cc1cc(ccc1Br)N(C)C 34a_100102888905_200000210301 [0,1,0,0,0,0|3,0,0]=4 824 B11R1.21 Cc1cc(ccc1Br)N(C)[13CH3] 2230a_100102888905_200025704644 [0,1,0,0,0,0|3,0,0]=4 825 B11R1.21 Cc1cc(ccc1Br)N(C)[13CH3] 269982a_100102888905_200025704644 [0,1,0,0,0,0|3,0,0]=4 826 B11R1.21 Cc1cc(ccc1Br)N(C)[13CH3] 34a_100102888905_200025704644 [0,1,0,0,0,0|3,0,0]=4 827 B11R1.21 Cc1cc(ccc1Cl)C(=O)[13CH3] 1458a_100000686306_200025704644 [0,1,0,0,0,0|1,0,0]=2 828 B11R1.21 Cc1cc(ccc1Cl)N(C)C 2230a_114849113799_200000210301 [0,1,0,0,0,0|3,0,0]=4 829 B11R1.21 Cc1cc(ccc1Cl)N(C)C 269982a_114849113799_200000210301 [0,1,0,0,0,0|3,0,0]=4 830 B11R1.21 Cc1cc(ccc1Cl)N(C)C 34a_114849113799_200000210301 [0,1,0,0,0,0|3,0,0]=4 831 B11R1.21 Cc1cc(ccc1Cl)N(C)[13CH3] 2230a_114849113799_200025704644 [0,1,0,0,0,0|3,0,0]=4 832 B11R1.21 Cc1cc(ccc1Cl)N(C)[13CH3] 269982a_114849113799_200025704644 [0,1,0,0,0,0|3,0,0]=4 833 B11R1.21 Cc1cc(ccc1Cl)N(C)[13CH3] 34a_114849113799_200025704644 [0,1,0,0,0,0|3,0,0]=4 834 B11R1.21 Cc1cc(ccc1F)C(=O)[13CH3] 1458a_100000751819_200025704644 [0,1,0,0,0,0|1,0,0]=2 835 B11R1.21 Cc1cc(ccc1F)N(C)C 2230a_100011756966_200000210301 [0,1,0,0,0,0|3,0,0]=4 836 B11R1.21 Cc1cc(ccc1F)N(C)C 269982a_100011756966_200000210301 [0,1,0,0,0,0|3,0,0]=4 837 B11R1.21 Cc1cc(ccc1F)N(C)C 34a_100011756966_200000210301 [0,1,0,0,0,0|3,0,0]=4 838 B11R1.21 Cc1cc(ccc1F)N(C)C 38a_100011756966_200000210301 [0,1,0,0,0,0|3,0,0]=4 839 B11R1.21 Cc1cc(ccc1F)N(C)C 7a_100011756966_200000210301 [0,1,0,0,0,0|3,0,0]=4 840 B11R1.21 Cc1cc(ccc1F)N(C)[13CH3] 2230a_100011756966_200025704644 [0,1,0,0,0,0|3,0,0]=4 841 B11R1.21 Cc1cc(ccc1F)N(C)[13CH3] 269982a_100011756966_200025704644 [0,1,0,0,0,0|3,0,0]=4 842 B11R1.21 Cc1cc(ccc1F)N(C)[13CH3] 34a_100011756966_200025704644 [0,1,0,0,0,0|3,0,0]=4 843 B11R1.21 Cc1cc(ccc1F)N(C)[13CH3] 38a_100011756966_200025704644 [0,1,0,0,0,0|3,0,0]=4 844 B11R1.21 Cc1cc(ccc1F)N(C)[13CH3] 7a_100011756966_200025704644 [0,1,0,0,0,0|3,0,0]=4 845 B11R1.21 Cc1cc(ccc1I)C(=O)[13CH3] 1458a_100000751300_200025704644 [0,1,0,0,0,0|1,0,0]=2 846 B11R1.21 Cc1cc(ccc1O)C(=O)N 271570a_203496583355_100011218126 [0,1,0,0,0,0|2,0,0]=3 847 B11R1.21 Cc1cc(ccc1O)C(=O)[13CH3] 1458a_100000685612_200025704644 [0,1,0,0,0,0|1,0,0]=2 848 B11R1.21 Cc1cc(ccc1O)N(C)C 271570a_203496583355_100011934168 [0,1,0,0,0,0|3,0,0]=4 849 B11R1.21 Cc1ccc(cc1Br)C(=O)[13CH3] 1458a_100000186397_200025704644 [0,1,0,0,0,0|0,0,0]=1 850 B11R1.21 Cc1ccc(cc1Br)N(C)C 2230a_100000707694_200000210301 [0,1,0,0,0,0|2,0,0]=3 851 B11R1.21 Cc1ccc(cc1Br)N(C)C 269982a_100000707694_200000210301 [0,1,0,0,0,0|2,0,0]=3 852 B11R1.21 Cc1ccc(cc1Br)N(C)C 34a_100000707694_200000210301 [0,1,0,0,0,0|2,0,0]=3 853 B11R1.21 Cc1ccc(cc1Br)N(C)C 38a_100000707694_200000210301 [0,1,0,0,0,0|2,0,0]=3 854 B11R1.21 Cc1ccc(cc1Br)N(C)[13CH3] 2230a_100000707694_200025704644 [0,1,0,0,0,0|2,0,0]=3 855 B11R1.21 Cc1ccc(cc1Br)N(C)[13CH3] 269982a_100000707694_200025704644 [0,1,0,0,0,0|2,0,0]=3 856 B11R1.21 Cc1ccc(cc1Br)N(C)[13CH3] 34a_100000707694_200025704644 [0,1,0,0,0,0|2,0,0]=3 857 B11R1.21 Cc1ccc(cc1Br)N(C)[13CH3] 38a_100000707694_200025704644 [0,1,0,0,0,0|2,0,0]=3 858 B11R1.21 Cc1ccc(cc1C)C(=O)[13CH3] 1458a_100000210898_200025704644 [0,1,0,0,0,0|0,0,0]=1 859 B11R1.21 Cc1ccc(cc1Cl)C(=O)[13CH3] 1458a_100000751740_200025704644 [0,1,0,0,0,0|0,0,0]=1 860 B11R1.21 Cc1ccc(cc1Cl)N(C)C 2230a_100000220120_200000210301 [0,1,0,0,0,0|2,0,0]=3 861 B11R1.21 Cc1ccc(cc1Cl)N(C)C 269982a_100000220120_200000210301 [0,1,0,0,0,0|2,0,0]=3 862 B11R1.21 Cc1ccc(cc1Cl)N(C)C 34a_100000220120_200000210301 [0,1,0,0,0,0|2,0,0]=3 863 B11R1.21 Cc1ccc(cc1Cl)N(C)C 38a_100000220120_200000210301 [0,1,0,0,0,0|2,0,0]=3 864 B11R1.21 Cc1ccc(cc1Cl)N(C)[13CH3] 2230a_100000220120_200025704644 [0,1,0,0,0,0|2,0,0]=3 865 B11R1.21 Cc1ccc(cc1Cl)N(C)[13CH3] 269982a_100000220120_200025704644 [0,1,0,0,0,0|2,0,0]=3 866 B11R1.21 Cc1ccc(cc1Cl)N(C)[13CH3] 34a_100000220120_200025704644 [0,1,0,0,0,0|2,0,0]=3 867 B11R1.21 Cc1ccc(cc1Cl)N(C)[13CH3] 38a_100000220120_200025704644 [0,1,0,0,0,0|2,0,0]=3 868 B11R1.21 Cc1ccc(cc1F)C(=O)[13CH3] 1458a_100000212313_200025704644 [0,1,0,0,0,0|0,0,0]=1 869 B11R1.21 Cc1ccc(cc1F)N(C)C 2230a_100160572069_200000210301 [0,1,0,0,0,0|2,0,0]=3 870 B11R1.21 Cc1ccc(cc1F)N(C)C 269982a_100160572069_200000210301 [0,1,0,0,0,0|2,0,0]=3 871 B11R1.21 Cc1ccc(cc1F)N(C)C 34a_100160572069_200000210301 [0,1,0,0,0,0|2,0,0]=3 872 B11R1.21 Cc1ccc(cc1F)N(C)C 38a_100160572069_200000210301 [0,1,0,0,0,0|2,0,0]=3 873 B11R1.21 Cc1ccc(cc1F)N(C)C 7a_100160572069_200000210301 [0,1,0,0,0,0|2,0,0]=3 874 B11R1.21 Cc1ccc(cc1F)N(C)[13CH3] 2230a_100160572069_200025704644 [0,1,0,0,0,0|2,0,0]=3 875 B11R1.21 Cc1ccc(cc1F)N(C)[13CH3] 269982a_100160572069_200025704644 [0,1,0,0,0,0|2,0,0]=3 876 B11R1.21 Cc1ccc(cc1F)N(C)[13CH3] 34a_100160572069_200025704644 [0,1,0,0,0,0|2,0,0]=3 877 B11R1.21 Cc1ccc(cc1F)N(C)[13CH3] 38a_100160572069_200025704644 [0,1,0,0,0,0|2,0,0]=3 878 B11R1.21 Cc1ccc(cc1F)N(C)[13CH3] 7a_100160572069_200025704644 [0,1,0,0,0,0|2,0,0]=3 879 B11R1.21 Cc1ccc(cc1I)C(=O)[13CH3] 1458a_100000751299_200025704644 [0,1,0,0,0,0|0,0,0]=1 880 B11R1.21 Cc1ccc(cc1O)B(O)O 271570a_203496583355_200010223333 [0,1,0,0,0,0|2,0,1]=4 881 B11R1.21 Cc1ccc(cc1O)C(=O)N 271570a_203496583355_100000186401 [0,1,0,0,0,0|1,0,0]=2 882 B11R1.21 Cc1ccc(cc1O)C(=O)[13CH3] 1458a_100000233767_200025704644 [0,1,0,0,0,0|0,0,0]=1 883 B11R1.21 Cc1cnc(cc1F)N(C)C 27a_100102631434_100009841206 [0,1,0,0,0,0|3,0,0]=4 884 B11R1.21 NC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100009814583 [0,1,0,0,0,0|2,0,0]=3 885 B11R1.21 NC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100000686215 [0,1,0,0,0,0|2,0,0]=3 886 B11R1.21 NC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100011202321 [0,1,0,0,0,0|2,0,0]=3 887 B11R1.21 NC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012344895 [0,1,0,0,0,0|2,0,0]=3 888 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_200025704644 [0,1,0,0,0,0|1,0,0]=2 889 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_200025704644 [0,1,0,0,0,0|1,0,0]=2 890 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)F 1458a_100000760357_200025704644 [0,1,0,0,0,0|1,0,0]=2 891 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)I 1458a_100000739115_200025704644 [0,1,0,0,0,0|1,0,0]=2 892 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)O 1458a_100000189672_200025704644 [0,1,0,0,0,0|1,0,0]=2 893 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_200025704644 [0,1,0,0,0,0|1,0,0]=2 894 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_200025704644 [0,1,0,0,0,0|1,0,0]=2 895 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_200025704644 [0,1,0,0,0,0|1,0,0]=2 896 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_200025704644 [0,1,0,0,0,0|1,0,0]=2 897 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_200025704644 [0,1,0,0,0,0|1,0,0]=2 898 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)Br 1458a_100000743946_200025704644 [0,1,0,0,0,0|1,0,0]=2 899 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_200025704644 [0,1,0,0,0,0|1,0,0]=2 900 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)F 1458a_100000209822_200025704644 [0,1,0,0,0,0|1,0,0]=2 901 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)I 1458a_100000062624_200025704644 [0,1,0,0,0,0|1,0,0]=2 902 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)O 1458a_100000185466_200025704644 [0,1,0,0,0,0|1,0,0]=2 903 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)Br 1458a_100012343876_200025704644 [0,1,0,0,0,0|1,0,0]=2 904 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_200025704644 [0,1,0,0,0,0|1,0,0]=2 905 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)F 1458a_100000688015_200025704644 [0,1,0,0,0,0|1,0,0]=2 906 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)I 1458a_100000725830_200025704644 [0,1,0,0,0,0|1,0,0]=2 907 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)O 1458a_100000037485_200025704644 [0,1,0,0,0,0|1,0,0]=2 908 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)Br 1458a_100000689001_200025704644 [0,1,0,0,0,0|1,0,0]=2 909 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_200025704644 [0,1,0,0,0,0|1,0,0]=2 910 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)F 1458a_100000035894_200025704644 [0,1,0,0,0,0|1,0,0]=2 911 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)I 1458a_100000239334_200025704644 [0,1,0,0,0,0|1,0,0]=2 912 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)O 1458a_100000212155_200025704644 [0,1,0,0,0,0|1,0,0]=2 913 B11R1.22 CC(C#N)c1ccc(cc1)O 271570a_203496583355_100000695319 [0,1,0,0,0,0|2,0,1]=4 914 B11R1.22 CC(O[13CH3])c1ccc(cc1)Br 34a_100000745893_200025704644 [0,1,0,0,0,0|1,0,2]=4 915 B11R1.22 CC(O[13CH3])c1ccc(cc1)Br 7a_100000745893_200025704644 [0,1,0,0,0,0|1,0,2]=4 916 B11R1.22 CC(O[13CH3])c1ccc(cc1)F 34a_100000181323_200025704644 [0,1,0,0,0,0|1,0,2]=4 917 B11R1.22 CC(O[13CH3])c1ccc(cc1)F 7a_100000181323_200025704644 [0,1,0,0,0,0|1,0,2]=4 918 B11R1.22 CC(O[13CH3])c1ccc(cc1)N 34a_100011216399_200025704644 [0,1,0,0,0,0|1,0,2]=4 919 B11R1.22 CC(S[13CH3])c1ccc(cc1)Br 62a_100000755118_200025704644 [0,1,0,0,0,0|1,1,1]=4 920 B11R1.22 CC(S[13CH3])c1ccc(cc1)Br 62a_200025704644_100000755118 [0,1,0,0,0,0|1,1,1]=4 921 B11R1.22 CC(S[13CH3])c1ccc(cc1)Cl 62a_100000684792_200025704644 [0,1,0,0,0,0|1,1,1]=4 922 B11R1.22 CC(S[13CH3])c1ccc(cc1)Cl 62a_200025704644_100000684792 [0,1,0,0,0,0|1,1,1]=4 923 B11R1.22 CC(S[13CH3])c1ccc(cc1)F 62a_100000743420_200025704644 [0,1,0,0,0,0|1,1,1]=4 924 B11R1.22 CC(S[13CH3])c1ccc(cc1)F 62a_200025704644_100000743420 [0,1,0,0,0,0|1,1,1]=4 925 B11R1.22 CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210202 [0,1,0,0,0,0|1,0,0]=2 926 B11R1.22 CCC(=O)c1ccc(cc1)C 1458a_100000188618_100000210202 [0,1,0,0,0,0|0,0,0]=1 927 B11R1.22 CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210202 [0,1,0,0,0,0|1,0,0]=2 928 B11R1.22 CCC(=O)c1ccc(cc1)F 1458a_100000187176_100000210202 [0,1,0,0,0,0|1,0,0]=2 929 B11R1.22 CCC(=O)c1ccc(cc1)I 1458a_100000187904_100000210202 [0,1,0,0,0,0|1,0,0]=2 930 B11R1.22 CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210202 [0,1,0,0,0,0|1,0,0]=2 931 B11R1.22 CCC(=O)c1ccc(cc1)O 271570a_203496583355_100000211647 [0,1,0,0,0,0|1,0,0]=2 932 B11R1.22 CCC(=O)c1ccc(cn1)O 271570a_203496583355_100012351654 [0,1,0,0,0,0|2,0,0]=3 933 B11R1.22 CCC(=O)c1ncc(cn1)O 271570a_203496583355_200010116844 [0,1,0,0,0,0|3,0,0]=4 934 B11R1.22 CCC(C)c1ccc(cc1)O 271570a_203496583355_100011221364 [0,1,0,0,0,0|2,0,1]=4 935 B11R1.22 CCC(O)c1ccc(cc1)O 271570a_203496583355_100000246506 [0,1,0,0,0,0|1,0,2]=4 936 B11R1.22 CCN(C)c1ccc(cc1)Br 2230a_100000219623_100000210202 [0,1,0,0,0,0|3,0,0]=4 937 B11R1.22 CCN(C)c1ccc(cc1)Br 2230a_100000219632_200000210301 [0,1,0,0,0,0|3,0,0]=4 938 B11R1.22 CCN(C)c1ccc(cc1)Br 269982a_100000219623_100000204670 [0,1,0,0,0,0|3,0,0]=4 939 B11R1.22 CCN(C)c1ccc(cc1)Br 269982a_100000219632_200000210301 [0,1,0,0,0,0|3,0,0]=4 940 B11R1.22 CCN(C)c1ccc(cc1)Br 34a_100000219623_100000210202 [0,1,0,0,0,0|3,0,0]=4 941 B11R1.22 CCN(C)c1ccc(cc1)Br 34a_100000219632_200000210301 [0,1,0,0,0,0|3,0,0]=4 942 B11R1.22 CCN(C)c1ccc(cc1)C 2230a_100000219977_100000210202 [0,1,0,0,0,0|2,0,0]=3 943 B11R1.22 CCN(C)c1ccc(cc1)C 2230a_100000219985_200000210301 [0,1,0,0,0,0|2,0,0]=3 944 B11R1.22 CCN(C)c1ccc(cc1)C 269982a_100000219977_100000204670 [0,1,0,0,0,0|2,0,0]=3 945 B11R1.22 CCN(C)c1ccc(cc1)C 269982a_100000219985_200000210301 [0,1,0,0,0,0|2,0,0]=3 946 B11R1.22 CCN(C)c1ccc(cc1)C 34a_100000219977_100000210202 [0,1,0,0,0,0|2,0,0]=3 947 B11R1.22 CCN(C)c1ccc(cc1)C 34a_100000219985_200000210301 [0,1,0,0,0,0|2,0,0]=3 948 B11R1.22 CCN(C)c1ccc(cc1)Cl 2230a_100000220165_200000210301 [0,1,0,0,0,0|3,0,0]=4 949 B11R1.22 CCN(C)c1ccc(cc1)Cl 2230a_100020629279_100000210202 [0,1,0,0,0,0|3,0,0]=4 950 B11R1.22 CCN(C)c1ccc(cc1)Cl 269982a_100000220165_200000210301 [0,1,0,0,0,0|3,0,0]=4 951 B11R1.22 CCN(C)c1ccc(cc1)Cl 269982a_100020629279_100000204670 [0,1,0,0,0,0|3,0,0]=4 952 B11R1.22 CCN(C)c1ccc(cc1)Cl 34a_100000220165_200000210301 [0,1,0,0,0,0|3,0,0]=4 953 B11R1.22 CCN(C)c1ccc(cc1)Cl 34a_100020629279_100000210202 [0,1,0,0,0,0|3,0,0]=4 954 B11R1.22 CCN(C)c1ccc(cc1)F 2230a_100000219829_100000210202 [0,1,0,0,0,0|3,0,0]=4 955 B11R1.22 CCN(C)c1ccc(cc1)F 2230a_100102640331_200000210301 [0,1,0,0,0,0|3,0,0]=4 956 B11R1.22 CCN(C)c1ccc(cc1)F 269982a_100000219829_100000204670 [0,1,0,0,0,0|3,0,0]=4 957 B11R1.22 CCN(C)c1ccc(cc1)F 269982a_100102640331_200000210301 [0,1,0,0,0,0|3,0,0]=4 958 B11R1.22 CCN(C)c1ccc(cc1)F 34a_100000219829_100000210202 [0,1,0,0,0,0|3,0,0]=4 959 B11R1.22 CCN(C)c1ccc(cc1)F 34a_100102640331_200000210301 [0,1,0,0,0,0|3,0,0]=4 960 B11R1.22 CCN(C)c1ccc(cc1)I 2230a_100000743151_100000210202 [0,1,0,0,0,0|3,0,0]=4 961 B11R1.22 CCN(C)c1ccc(cc1)I 269982a_100000743151_100000204670 [0,1,0,0,0,0|3,0,0]=4 962 B11R1.22 CCN(C)c1ccc(cc1)I 34a_100000743151_100000210202 [0,1,0,0,0,0|3,0,0]=4 963 B11R1.22 CCN(C)c1ccc(cc1)O 2230a_100011337800_200000210301 [0,1,0,0,0,0|3,0,0]=4 964 B11R1.22 CCN(C)c1ccc(cc1)O 269982a_100000182112_100000204670 [0,1,0,0,0,0|3,0,0]=4 965 B11R1.22 CCN(C)c1ccc(cc1)O 269982a_100011337800_200000210301 [0,1,0,0,0,0|3,0,0]=4 966 B11R1.22 CCN(C)c1ccc(cc1)O 34a_100000182112_100000210202 [0,1,0,0,0,0|3,0,0]=4 967 B11R1.22 CCN(C)c1ccc(cc1)O 34a_100011337800_200000210301 [0,1,0,0,0,0|3,0,0]=4 968 B11R1.22 CCN([13CH3])c1ccc(cc1)Br 2230a_100000219632_200025704644 [0,1,0,0,0,0|3,0,0]=4 969 B11R1.22 CCN([13CH3])c1ccc(cc1)Br 269982a_100000219632_200025704644 [0,1,0,0,0,0|3,0,0]=4 970 B11R1.22 CCN([13CH3])c1ccc(cc1)Br 34a_100000219632_200025704644 [0,1,0,0,0,0|3,0,0]=4 971 B11R1.22 CCN([13CH3])c1ccc(cc1)C 2230a_100000219985_200025704644 [0,1,0,0,0,0|2,0,0]=3 972 B11R1.22 CCN([13CH3])c1ccc(cc1)C 269982a_100000219985_200025704644 [0,1,0,0,0,0|2,0,0]=3 973 B11R1.22 CCN([13CH3])c1ccc(cc1)C 34a_100000219985_200025704644 [0,1,0,0,0,0|2,0,0]=3 974 B11R1.22 CCN([13CH3])c1ccc(cc1)Cl 2230a_100000220165_200025704644 [0,1,0,0,0,0|3,0,0]=4 975 B11R1.22 CCN([13CH3])c1ccc(cc1)Cl 269982a_100000220165_200025704644 [0,1,0,0,0,0|3,0,0]=4 976 B11R1.22 CCN([13CH3])c1ccc(cc1)Cl 34a_100000220165_200025704644 [0,1,0,0,0,0|3,0,0]=4 977 B11R1.22 CCN([13CH3])c1ccc(cc1)F 2230a_100102640331_200025704644 [0,1,0,0,0,0|3,0,0]=4 978 B11R1.22 CCN([13CH3])c1ccc(cc1)F 269982a_100102640331_200025704644 [0,1,0,0,0,0|3,0,0]=4 979 B11R1.22 CCN([13CH3])c1ccc(cc1)F 34a_100102640331_200025704644 [0,1,0,0,0,0|3,0,0]=4 980 B11R1.22 CCN([13CH3])c1ccc(cc1)O 2230a_100011337800_200025704644 [0,1,0,0,0,0|3,0,0]=4 981 B11R1.22 CCN([13CH3])c1ccc(cc1)O 269982a_100011337800_200025704644 [0,1,0,0,0,0|3,0,0]=4 982 B11R1.22 CCN([13CH3])c1ccc(cc1)O 34a_100011337800_200025704644 [0,1,0,0,0,0|3,0,0]=4 983 B11R1.22 CC[C@H](N)c1ccc(cc1)O 271570a_203496583355_100025736560 [0,1,0,0,0,0|2,0,1]=4 984 B11R1.22 CN(CF)c1ccc(cc1)Br 269982a_100000219623_100015361967 [0,1,0,0,0,0|3,0,0]=4 985 B11R1.22 CN(CF)c1ccc(cc1)Br 34a_100000219623_100015361967 [0,1,0,0,0,0|3,0,0]=4 986 B11R1.22 CN(CF)c1ccc(cc1)Cl 269982a_100020629279_100015361967 [0,1,0,0,0,0|3,0,0]=4 987 B11R1.22 CN(CF)c1ccc(cc1)Cl 34a_100020629279_100015361967 [0,1,0,0,0,0|3,0,0]=4 988 B11R1.22 CN(CF)c1ccc(cc1)F 269982a_100000219829_100015361967 [0,1,0,0,0,0|3,0,0]=4 989 B11R1.22 CN(CF)c1ccc(cc1)F 34a_100000219829_100015361967 [0,1,0,0,0,0|3,0,0]=4 990 B11R1.22 CN(CF)c1ccc(cc1)I 269982a_100000743151_100015361967 [0,1,0,0,0,0|3,0,0]=4 991 B11R1.22 CN(CF)c1ccc(cc1)I 34a_100000743151_100015361967 [0,1,0,0,0,0|3,0,0]=4 992 B11R1.22 CN(CF)c1ccc(cc1)O 269982a_100000182112_100015361967 [0,1,0,0,0,0|3,0,0]=4 993 B11R1.22 CN(CF)c1ccc(cc1)O 34a_100000182112_100015361967 [0,1,0,0,0,0|3,0,0]=4 994 B11R1.22 CNC(=O)c1ccc(cc1)Br 11a_106832991635_100000185839 [0,1,0,0,0,0|1,0,0]=2 995 B11R1.22 CNC(=O)c1ccc(cc1)Br 1626a_100102657272_100000185839 [0,1,0,0,0,0|1,0,0]=2 996 B11R1.22 CNC(=O)c1ccc(cc1)Br 240690a_100102657272_100000185839 [0,1,0,0,0,0|1,0,0]=2 997 B11R1.22 CNC(=O)c1ccc(cc1)Br 527a_100102657272_100000185839 [0,1,0,0,0,0|1,0,0]=2 998 B11R1.22 CNC(=O)c1ccc(cc1)C 11a_106832991635_100000188618 [0,1,0,0,0,0|0,0,0]=1 999 B11R1.22 CNC(=O)c1ccc(cc1)C 1626a_100102657272_100000188618 [0,1,0,0,0,0|0,0,0]=1 1000 B11R1.22 CNC(=O)c1ccc(cc1)C 240690a_100102657272_100000188618 [0,1,0,0,0,0|0,0,0]=1 1001 B11R1.22 CNC(=O)c1ccc(cc1)C 527a_100102657272_100000188618 [0,1,0,0,0,0|0,0,0]=1 1002 B11R1.22 CNC(=O)c1ccc(cc1)Cl 11a_106832991635_100000210187 [0,1,0,0,0,0|1,0,0]=2 1003 B11R1.22 CNC(=O)c1ccc(cc1)Cl 1626a_100102657272_100000210187 [0,1,0,0,0,0|1,0,0]=2 1004 B11R1.22 CNC(=O)c1ccc(cc1)Cl 240690a_100102657272_100000210187 [0,1,0,0,0,0|1,0,0]=2 1005 B11R1.22 CNC(=O)c1ccc(cc1)Cl 527a_100102657272_100000210187 [0,1,0,0,0,0|1,0,0]=2 1006 B11R1.22 CNC(=O)c1ccc(cc1)F 11a_106832991635_100000187176 [0,1,0,0,0,0|1,0,0]=2 1007 B11R1.22 CNC(=O)c1ccc(cc1)F 1626a_100102657272_100000187176 [0,1,0,0,0,0|1,0,0]=2 1008 B11R1.22 CNC(=O)c1ccc(cc1)F 240690a_100102657272_100000187176 [0,1,0,0,0,0|1,0,0]=2 1009 B11R1.22 CNC(=O)c1ccc(cc1)F 527a_100102657272_100000187176 [0,1,0,0,0,0|1,0,0]=2 1010 B11R1.22 CNC(=O)c1ccc(cc1)I 11a_106832991635_100000187904 [0,1,0,0,0,0|1,0,0]=2 1011 B11R1.22 CNC(=O)c1ccc(cc1)I 1626a_100102657272_100000187904 [0,1,0,0,0,0|1,0,0]=2 1012 B11R1.22 CNC(=O)c1ccc(cc1)I 240690a_100102657272_100000187904 [0,1,0,0,0,0|1,0,0]=2 1013 B11R1.22 CNC(=O)c1ccc(cc1)I 527a_100102657272_100000187904 [0,1,0,0,0,0|1,0,0]=2 1014 B11R1.22 CNC(=O)c1ccc(cc1)O 240690a_100102657272_100000212099 [0,1,0,0,0,0|1,0,0]=2 1015 B11R1.22 CNC(=O)c1ccc(cc1)O 271570a_203496583355_100000155074 [0,1,0,0,0,0|1,0,0]=2 1016 B11R1.22 CNC(=O)c1ccc(cc1)O 527a_100102657272_100000212099 [0,1,0,0,0,0|1,0,0]=2 1017 B11R1.22 CNC(=O)c1ccc(cn1)O 271570a_203496583355_100011781262 [0,1,0,0,0,0|2,0,0]=3 1018 B11R1.22 CNC(=O)c1ccc(nc1)O 271570a_203496583355_100000159860 [0,1,0,0,0,0|2,0,0]=3 1019 B11R1.22 CNC(=O)c1ncc(cn1)O 271570a_203496583355_200010127873 [0,1,0,0,0,0|3,0,0]=4 1020 B11R1.22 CNC(C)c1ccc(cc1)Br 2230a_106832991635_100000755118 [0,1,0,0,0,0|2,0,1]=4 1021 B11R1.22 CNC(C)c1ccc(cc1)Br 269862a_106832991636_100000185794 [0,1,0,0,0,0|2,0,1]=4 1022 B11R1.22 CNC(C)c1ccc(cc1)Br 34a_100102657272_100000755118 [0,1,0,0,0,0|2,0,1]=4 1023 B11R1.22 CNC(C)c1ccc(cc1)C 2230a_106832991635_100011261388 [0,1,0,0,0,0|1,0,1]=3 1024 B11R1.22 CNC(C)c1ccc(cc1)C 269862a_106832991636_100000185793 [0,1,0,0,0,0|1,0,1]=3 1025 B11R1.22 CNC(C)c1ccc(cc1)C 34a_100102657272_100011261388 [0,1,0,0,0,0|1,0,1]=3 1026 B11R1.22 CNC(C)c1ccc(cc1)C 7a_106832991635_100011261388 [0,1,0,0,0,0|1,0,1]=3 1027 B11R1.22 CNC(C)c1ccc(cc1)Cl 2230a_106832991635_100000684792 [0,1,0,0,0,0|2,0,1]=4 1028 B11R1.22 CNC(C)c1ccc(cc1)Cl 269862a_106832991636_100000185797 [0,1,0,0,0,0|2,0,1]=4 1029 B11R1.22 CNC(C)c1ccc(cc1)Cl 7a_106832991635_100000684792 [0,1,0,0,0,0|2,0,1]=4 1030 B11R1.22 CNC(C)c1ccc(cc1)F 2230a_106832991635_100000743420 [0,1,0,0,0,0|2,0,1]=4 1031 B11R1.22 CNC(C)c1ccc(cc1)F 269862a_106832991636_100000185800 [0,1,0,0,0,0|2,0,1]=4 1032 B11R1.22 CNC(C)c1ccc(cc1)F 34a_100102657272_100000743420 [0,1,0,0,0,0|2,0,1]=4 1033 B11R1.22 CNC(C)c1ccc(cc1)F 7a_106832991635_100000743420 [0,1,0,0,0,0|2,0,1]=4 1034 B11R1.22 CNC(C)c1ccc(cc1)I 269862a_106832991636_100000185465 [0,1,0,0,0,0|2,0,1]=4 1035 B11R1.22 CNC(C)c1ccc(cc1)O 271570a_203496583355_100000231103 [0,1,0,0,0,0|2,0,1]=4 1036 B11R1.22 CNC(C)c1ccc(cn1)C 269862a_106832991636_100000084104 [0,1,0,0,0,0|2,0,1]=4 1037 B11R1.22 CNC(C)c1ccc(cn1)C 270004a_106832991635_100000084104 [0,1,0,0,0,0|2,0,1]=4 1038 B11R1.22 CNC(C)c1ccc(nc1)C 2230a_100011815741_200000210301 [0,1,0,0,0,0|2,0,1]=4 1039 B11R1.22 CNC(C)c1ccc(nc1)C 269862a_106832991636_100011280547 [0,1,0,0,0,0|2,0,1]=4 1040 B11R1.22 CNC(C)c1ccc(nc1)C 34a_100011815741_200000210301 [0,1,0,0,0,0|2,0,1]=4 1041 B11R1.22 CN[C@@H](C)c1ccc(cc1)F 2230a_100025705893_200000210301 [0,1,0,0,0,0|2,0,1]=4 1042 B11R1.22 CN[C@@H](C)c1ccc(cc1)F 34a_100025705893_200000210301 [0,1,0,0,0,0|2,0,1]=4 1043 B11R1.22 CN[C@@H](C)c1ccc(cc1)I 2230a_100000753911_200000210301 [0,1,0,0,0,0|2,0,1]=4 1044 B11R1.22 CN[C@@H](C)c1ccc(cc1)O 2230a_100161106496_200000210301 [0,1,0,0,0,0|2,0,1]=4 1045 B11R1.22 CN[C@H](C)c1ccc(cc1)Br 2230a_100000720352_200000210301 [0,1,0,0,0,0|2,0,1]=4 1046 B11R1.22 CN[C@H](C)c1ccc(cc1)C 2230a_100016988085_200000210301 [0,1,0,0,0,0|1,0,1]=3 1047 B11R1.22 CN[C@H](C)c1ccc(cc1)C 34a_100016988085_200000210301 [0,1,0,0,0,0|1,0,1]=3 1048 B11R1.22 CN[C@H](C)c1ccc(cc1)Cl 2230a_100015205461_200000210301 [0,1,0,0,0,0|2,0,1]=4 1049 B11R1.22 CN[C@H](C)c1ccc(cc1)Cl 34a_100015205461_200000210301 [0,1,0,0,0,0|2,0,1]=4 1050 B11R1.22 COC(=O)c1ccc(cc1)O 271570a_203496583355_100000150774 [0,1,0,0,0,0|1,0,0]=2 1051 B11R1.22 COC(=O)c1ccc(cn1)O 271570a_203496583355_100000690920 [0,1,0,0,0,0|2,0,0]=3 1052 B11R1.22 COC(=O)c1ccc(nc1)O 271570a_203496583355_100000733799 [0,1,0,0,0,0|2,0,0]=3 1053 B11R1.22 COC(=O)c1ccc(nn1)O 271570a_203496583355_100009816182 [0,1,0,0,0,0|3,0,0]=4 1054 B11R1.22 COC(=O)c1cnc(cn1)O 271570a_203496583355_100010219404 [0,1,0,0,0,0|3,0,0]=4 1055 B11R1.22 COC(=O)c1cnc(nc1)O 271570a_203496583355_100000729365 [0,1,0,0,0,0|3,0,0]=4 1056 B11R1.22 COC(=O)c1ncc(cn1)O 271570a_203496583355_100000690087 [0,1,0,0,0,0|3,0,0]=4 1057 B11R1.22 COC(C)c1ccc(cc1)Br 34a_100000745893_200000210301 [0,1,0,0,0,0|1,0,2]=4 1058 B11R1.22 COC(C)c1ccc(cc1)Br 34a_100138415774_100000755118 [0,1,0,0,0,0|1,0,2]=4 1059 B11R1.22 COC(C)c1ccc(cc1)Br 7a_100000745893_200000210301 [0,1,0,0,0,0|1,0,2]=4 1060 B11R1.22 COC(C)c1ccc(cc1)C 34a_100138415774_100011261388 [0,1,0,0,0,0|0,0,2]=3 1061 B11R1.22 COC(C)c1ccc(cc1)F 34a_100000181323_200000210301 [0,1,0,0,0,0|1,0,2]=4 1062 B11R1.22 COC(C)c1ccc(cc1)F 34a_100138415774_100000743420 [0,1,0,0,0,0|1,0,2]=4 1063 B11R1.22 COC(C)c1ccc(cc1)F 7a_100000181323_200000210301 [0,1,0,0,0,0|1,0,2]=4 1064 B11R1.22 COC(C)c1ccc(cc1)N 34a_100011216399_200000210301 [0,1,0,0,0,0|1,0,2]=4 1065 B11R1.22 COC(C)c1ccc(cc1)O 271570a_203496583355_100010254937 [0,1,0,0,0,0|1,0,2]=4 1066 B11R1.22 COC(C)c1ccc(nc1)C 34a_200011815720_200000210301 [0,1,0,0,0,0|1,0,2]=4 1067 B11R1.22 COC(C)c1ccc(nc1)C 7a_200011815720_200000210301 [0,1,0,0,0,0|1,0,2]=4 1068 B11R1.22 CO[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_200000210301 [0,1,0,0,0,0|1,0,2]=4 1069 B11R1.22 CO[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_200000210301 [0,1,0,0,0,0|1,0,2]=4 1070 B11R1.22 CO[C@H](C)c1ccc(cc1)C 34a_100000690690_200000210301 [0,1,0,0,0,0|0,0,2]=3 1071 B11R1.22 CO[C@H](C)c1ccc(cc1)C 7a_100000690690_200000210301 [0,1,0,0,0,0|0,0,2]=3 1072 B11R1.22 CSC(C)c1ccc(cc1)Br 62a_100000755118_200000210301 [0,1,0,0,0,0|1,1,1]=4 1073 B11R1.22 CSC(C)c1ccc(cc1)Br 62a_200000210301_100000755118 [0,1,0,0,0,0|1,1,1]=4 1074 B11R1.22 CSC(C)c1ccc(cc1)C 62a_100011261388_200000210301 [0,1,0,0,0,0|0,1,1]=3 1075 B11R1.22 CSC(C)c1ccc(cc1)C 62a_200000210301_100011261388 [0,1,0,0,0,0|0,1,1]=3 1076 B11R1.22 CSC(C)c1ccc(cc1)Cl 62a_100000684792_200000210301 [0,1,0,0,0,0|1,1,1]=4 1077 B11R1.22 CSC(C)c1ccc(cc1)Cl 62a_200000210301_100000684792 [0,1,0,0,0,0|1,1,1]=4 1078 B11R1.22 CSC(C)c1ccc(cc1)F 62a_100000743420_200000210301 [0,1,0,0,0,0|1,1,1]=4 1079 B11R1.22 CSC(C)c1ccc(cc1)F 62a_200000210301_100000743420 [0,1,0,0,0,0|1,1,1]=4 1080 B11R1.22 C[C@@H](N[13CH3])c1ccc(cc1)Br 2230a_100000720352_200025704644 [0,1,0,0,0,0|2,0,1]=4 1081 B11R1.22 C[C@@H](N[13CH3])c1ccc(cc1)Cl 2230a_100015205461_200025704644 [0,1,0,0,0,0|2,0,1]=4 1082 B11R1.22 C[C@@H](N[13CH3])c1ccc(cc1)Cl 34a_100015205461_200025704644 [0,1,0,0,0,0|2,0,1]=4 1083 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)F 2230a_100025705893_200025704644 [0,1,0,0,0,0|2,0,1]=4 1084 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)F 34a_100025705893_200025704644 [0,1,0,0,0,0|2,0,1]=4 1085 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)I 2230a_100000753911_200025704644 [0,1,0,0,0,0|2,0,1]=4 1086 B11R1.22 C[C@H](N[13CH3])c1ccc(cc1)O 2230a_100161106496_200025704644 [0,1,0,0,0,0|2,0,1]=4 1087 B11R1.22 C[C@H](O[13CH3])c1ccc(cc1)Cl 34a_100011852131_200025704644 [0,1,0,0,0,0|1,0,2]=4 1088 B11R1.22 C[C@H](O[13CH3])c1ccc(cc1)Cl 7a_100011852131_200025704644 [0,1,0,0,0,0|1,0,2]=4 1089 B11R1.22 Cc1ccc(cc1)C(=O)CF 1458a_100000188618_100015361967 [0,1,0,0,0,0|0,0,0]=1 1090 B11R1.22 Cc1ccc(cc1)C(C)S[13CH3] 62a_100011261388_200025704644 [0,1,0,0,0,0|0,1,1]=3 1091 B11R1.22 Cc1ccc(cc1)C(C)S[13CH3] 62a_200025704644_100011261388 [0,1,0,0,0,0|0,1,1]=3 1092 B11R1.22 Cc1ccc(cc1)N(C)CF 269982a_100000219977_100015361967 [0,1,0,0,0,0|2,0,0]=3 1093 B11R1.22 Cc1ccc(cc1)N(C)CF 34a_100000219977_100015361967 [0,1,0,0,0,0|2,0,0]=3 1094 B11R1.22 Cc1ccc(cc1)[C@@H](C)N[13CH3] 2230a_100016988085_200025704644 [0,1,0,0,0,0|1,0,1]=3 1095 B11R1.22 Cc1ccc(cc1)[C@@H](C)N[13CH3] 34a_100016988085_200025704644 [0,1,0,0,0,0|1,0,1]=3 1096 B11R1.22 Cc1ccc(cc1)[C@@H](C)O[13CH3] 34a_100000690690_200025704644 [0,1,0,0,0,0|0,0,2]=3 1097 B11R1.22 Cc1ccc(cc1)[C@@H](C)O[13CH3] 7a_100000690690_200025704644 [0,1,0,0,0,0|0,0,2]=3 1098 B11R1.22 Cc1ccc(cn1)C(C)N[13CH3] 2230a_100011815741_200025704644 [0,1,0,0,0,0|2,0,1]=4 1099 B11R1.22 Cc1ccc(cn1)C(C)N[13CH3] 34a_100011815741_200025704644 [0,1,0,0,0,0|2,0,1]=4 1100 B11R1.22 Cc1ccc(cn1)C(C)O[13CH3] 34a_200011815720_200025704644 [0,1,0,0,0,0|1,0,2]=4 1101 B11R1.22 Cc1ccc(cn1)C(C)O[13CH3] 7a_200011815720_200025704644 [0,1,0,0,0,0|1,0,2]=4 1102 B11R1.22 N#CC(=O)c1ccc(cc1)O 271570a_203496583355_100009994572 [0,1,0,0,0,0|1,0,1]=3 1103 B11R1.22 NC(CO)c1ccc(cc1)O 271570a_203496583355_100000734186 [0,1,0,0,0,0|2,0,1]=4 1104 B11R1.22 NCC(=O)c1ccc(cc1)O 271570a_203496583355_100000017248 [0,1,0,0,0,0|1,0,0]=2 1105 B11R1.22 NCC(O)c1ccc(cc1)O 271570a_203496583355_100020626992 [0,1,0,0,0,0|1,0,2]=4 1106 B11R1.22 NNC(=O)c1ccc(cc1)O 271570a_203496583355_100000183614 [0,1,0,0,0,0|2,0,0]=3 1107 B11R1.22 NNC(=O)c1ccc(cn1)O 271570a_203496583355_100011781063 [0,1,0,0,0,0|3,0,0]=4 1108 B11R1.22 NNC(=O)c1ccc(nc1)O 271570a_203496583355_100000189807 [0,1,0,0,0,0|3,0,0]=4 1109 B11R1.22 O=C(CF)c1ccc(cc1)Br 1458a_100000185839_100015361967 [0,1,0,0,0,0|1,0,0]=2 1110 B11R1.22 O=C(CF)c1ccc(cc1)Cl 1458a_100000210187_100015361967 [0,1,0,0,0,0|1,0,0]=2 1111 B11R1.22 O=C(CF)c1ccc(cc1)F 1458a_100000187176_100015361967 [0,1,0,0,0,0|1,0,0]=2 1112 B11R1.22 O=C(CF)c1ccc(cc1)I 1458a_100000187904_100015361967 [0,1,0,0,0,0|1,0,0]=2 1113 B11R1.22 O=C(CF)c1ccc(cc1)O 1458a_100000212099_100015361967 [0,1,0,0,0,0|1,0,0]=2 1114 B11R1.22 O=C(CO)c1ccc(cc1)O 271570a_203496583355_100011219529 [0,1,0,0,0,0|1,0,0]=2 1115 B11R1.22 O=CC(=O)c1ccc(cc1)O 271570a_203496583355_100000725942 [0,1,0,0,0,0|1,0,1]=3 1116 B11R1.22 OCC(O)c1ccc(cc1)O 271570a_203496583355_200012355997 [0,1,0,0,0,0|1,0,2]=4 1117 B11R1.22 [2H]C(OC)c1ccc(cc1)F 34a_217856618577_200000210301 [0,1,0,0,0,0|2,0,1]=4 1118 B11R1.22 [2H]C(OC)c1ccc(cc1)F 7a_217856618577_200000210301 [0,1,0,0,0,0|2,0,1]=4 1119 B11R1.22 [2H]C(O[13CH3])c1ccc(cc1)F 34a_217856618577_200025704644 [0,1,0,0,0,0|2,0,1]=4 1120 B11R1.22 [2H]C(O[13CH3])c1ccc(cc1)F 7a_217856618577_200025704644 [0,1,0,0,0,0|2,0,1]=4 1121 B11R1.166 C=C(C)c1c[nH]c(=O)cc1F 271570a_100000694244_100015631685 [0,1,0,0,0,0|3,0,0]=4 1122 B11R1.166 C=C(C)c1cc[n+](cc1C)[O-] 271570a_100000694244_100000074940 [0,1,0,0,0,0|3,0,0]=4 1123 B11R1.166 C=C(C)c1ccc(=O)[nH]c1N 271570a_100000694244_100009884077 [0,1,0,0,0,0|3,0,0]=4 1124 B11R1.166 C=C(C)c1ccc(c[n+]1[O-])C 271570a_100000694244_100009819918 [0,1,0,0,0,0|2,0,0]=3 1125 B11R1.166 C=C(C)c1ccc(c[n+]1[O-])F 271570a_100000694244_100009817261 [0,1,0,0,0,0|3,0,0]=4 1126 B11R1.166 C=C(C)c1ccc(cc1Br)Br 271570a_100000694244_100011484698 [0,1,0,0,0,0|2,0,0]=3 1127 B11R1.166 C=C(C)c1ccc(cc1Br)C 271570a_100000694244_100009813563 [0,1,0,0,0,0|1,0,0]=2 1128 B11R1.166 C=C(C)c1ccc(cc1Br)Cl 271570a_100000694244_100011219703 [0,1,0,0,0,0|2,0,0]=3 1129 B11R1.166 C=C(C)c1ccc(cc1Br)F 271570a_100000694244_100011217111 [0,1,0,0,0,0|2,0,0]=3 1130 B11R1.166 C=C(C)c1ccc(cc1Br)N 271570a_100000694244_100000750458 [0,1,0,0,0,0|2,0,0]=3 1131 B11R1.166 C=C(C)c1ccc(cc1Br)O 271570a_100000694244_100000701344 [0,1,0,0,0,0|2,0,0]=3 1132 B11R1.166 C=C(C)c1ccc(cc1C)Br 271570a_100000694244_100000701812 [0,1,0,0,0,0|2,0,0]=3 1133 B11R1.166 C=C(C)c1ccc(cc1C)C 271570a_100000694244_100011217332 [0,1,0,0,0,0|1,0,0]=2 1134 B11R1.166 C=C(C)c1ccc(cc1C)Cl 271570a_100000694244_100011219607 [0,1,0,0,0,0|2,0,0]=3 1135 B11R1.166 C=C(C)c1ccc(cc1C)F 271570a_100000694244_100011205405 [0,1,0,0,0,0|2,0,0]=3 1136 B11R1.166 C=C(C)c1ccc(cc1C)N 271570a_100000694244_100000210723 [0,1,0,0,0,0|2,0,0]=3 1137 B11R1.166 C=C(C)c1ccc(cc1C)O 271570a_100000694244_100000729255 [0,1,0,0,0,0|2,0,0]=3 1138 B11R1.166 C=C(C)c1ccc(cc1Cl)Br 271570a_100000694244_100011216062 [0,1,0,0,0,0|2,0,0]=3 1139 B11R1.166 C=C(C)c1ccc(cc1Cl)C 271570a_100000694244_100011263221 [0,1,0,0,0,0|1,0,0]=2 1140 B11R1.166 C=C(C)c1ccc(cc1Cl)Cl 271570a_100000694244_100000699841 [0,1,0,0,0,0|2,0,0]=3 1141 B11R1.166 C=C(C)c1ccc(cc1Cl)F 271570a_100000694244_100000733362 [0,1,0,0,0,0|2,0,0]=3 1142 B11R1.166 C=C(C)c1ccc(cc1Cl)N 271570a_100000694244_100000761885 [0,1,0,0,0,0|2,0,0]=3 1143 B11R1.166 C=C(C)c1ccc(cc1Cl)O 271570a_100000694244_100000047559 [0,1,0,0,0,0|2,0,0]=3 1144 B11R1.166 C=C(C)c1ccc(cc1F)Br 271570a_100000694244_100009814013 [0,1,0,0,0,0|2,0,0]=3 1145 B11R1.166 C=C(C)c1ccc(cc1F)C 271570a_100000694244_100011216119 [0,1,0,0,0,0|1,0,0]=2 1146 B11R1.166 C=C(C)c1ccc(cc1F)Cl 271570a_100000694244_100011216042 [0,1,0,0,0,0|2,0,0]=3 1147 B11R1.166 C=C(C)c1ccc(cc1F)F 271570a_100000694244_100000750030 [0,1,0,0,0,0|2,0,0]=3 1148 B11R1.166 C=C(C)c1ccc(cc1F)N 271570a_100000694244_100011356925 [0,1,0,0,0,0|2,0,0]=3 1149 B11R1.166 C=C(C)c1ccc(cc1F)O 271570a_100000694244_100000755031 [0,1,0,0,0,0|2,0,0]=3 1150 B11R1.166 C=C(C)c1ccc(cc1N)Br 271570a_100000694244_100000743836 [0,1,0,0,0,0|2,0,0]=3 1151 B11R1.166 C=C(C)c1ccc(cc1N)C 271570a_100000694244_100011216686 [0,1,0,0,0,0|1,0,0]=2 1152 B11R1.166 C=C(C)c1ccc(cc1N)Cl 271570a_100000694244_100000761886 [0,1,0,0,0,0|2,0,0]=3 1153 B11R1.166 C=C(C)c1ccc(cc1N)F 271570a_100000694244_100011218093 [0,1,0,0,0,0|2,0,0]=3 1154 B11R1.166 C=C(C)c1ccc(cc1N)N 271570a_100000694244_200012175722 [0,1,0,0,0,0|2,0,0]=3 1155 B11R1.166 C=C(C)c1ccc(cc1N)O 271570a_100000694244_100011999798 [0,1,0,0,0,0|2,0,0]=3 1156 B11R1.166 C=C(C)c1ccc(cc1O)Br 271570a_100000694244_100012344904 [0,1,0,0,0,0|2,0,0]=3 1157 B11R1.166 C=C(C)c1ccc(cc1O)C 271570a_100000694244_100012002257 [0,1,0,0,0,0|1,0,0]=2 1158 B11R1.166 C=C(C)c1ccc(cc1O)Cl 271570a_100000694244_100000050036 [0,1,0,0,0,0|2,0,0]=3 1159 B11R1.166 C=C(C)c1ccc(cc1O)F 271570a_100000694244_100000690578 [0,1,0,0,0,0|2,0,0]=3 1160 B11R1.166 C=C(C)c1ccc(cc1O)O 271570a_100000694244_100009813921 [0,1,0,0,0,0|2,0,0]=3 1161 B11R1.166 C=C(C)c1ccc(nc1Br)N 271570a_100000694244_100010734177 [0,1,0,0,0,0|3,0,0]=4 1162 B11R1.166 C=C(C)c1ccc(nc1C)C 271570a_100000694244_100009813853 [0,1,0,0,0,0|2,0,0]=3 1163 B11R1.166 C=C(C)c1ccc(nc1C)Cl 271570a_100000694244_100000062408 [0,1,0,0,0,0|3,0,0]=4 1164 B11R1.166 C=C(C)c1ccc(nc1C)F 271570a_100000694244_100000688911 [0,1,0,0,0,0|3,0,0]=4 1165 B11R1.166 C=C(C)c1ccc(nc1C)N 271570a_100000694244_100000013003 [0,1,0,0,0,0|3,0,0]=4 1166 B11R1.166 C=C(C)c1ccc(nc1C)O 271570a_100000694244_100000691680 [0,1,0,0,0,0|3,0,0]=4 1167 B11R1.166 C=C(C)c1ccc(nc1Cl)Br 271570a_100000694244_100010246183 [0,1,0,0,0,0|3,0,0]=4 1168 B11R1.166 C=C(C)c1ccc(nc1Cl)N 271570a_100000694244_100010270343 [0,1,0,0,0,0|3,0,0]=4 1169 B11R1.166 C=C(C)c1ccc(nc1F)C 271570a_100000694244_100010006597 [0,1,0,0,0,0|2,0,0]=3 1170 B11R1.166 C=C(C)c1ccc(nc1F)Cl 271570a_100000694244_100010168078 [0,1,0,0,0,0|3,0,0]=4 1171 B11R1.166 C=C(C)c1ccc(nc1F)F 271570a_100000694244_100000070099 [0,1,0,0,0,0|3,0,0]=4 1172 B11R1.166 C=C(C)c1ccc(nc1F)N 271570a_100000694244_100009882772 [0,1,0,0,0,0|3,0,0]=4 1173 B11R1.166 C=C(C)c1ccc(nc1F)O 271570a_100000694244_100009879308 [0,1,0,0,0,0|3,0,0]=4 1174 B11R1.166 C=C(C)c1ccc(nc1N)C 271570a_100000694244_100009816662 [0,1,0,0,0,0|2,0,0]=3 1175 B11R1.166 C=C(C)c1ccc(nc1N)Cl 271570a_100000694244_100010171640 [0,1,0,0,0,0|3,0,0]=4 1176 B11R1.166 C=C(C)c1ccc(nc1N)F 271570a_100000694244_100009854977 [0,1,0,0,0,0|3,0,0]=4 1177 B11R1.166 C=C(C)c1ccc(nc1N)N 271570a_100000694244_100011356871 [0,1,0,0,0,0|3,0,0]=4 1178 B11R1.166 C=C(C)c1ccc(nc1O)C 271570a_100000694244_100009817604 [0,1,0,0,0,0|2,0,0]=3 1179 B11R1.166 C=C(C)c1cnc([nH]c1=O)C 271570a_100000694244_100011999157 [0,1,0,0,0,0|3,0,0]=4 1180 B11R1.166 C=C(C)c1cnc(cc1Br)F 271570a_100000694244_100015451857 [0,1,0,0,0,0|3,0,0]=4 1181 B11R1.166 C=C(C)c1cnc(cc1Br)N 271570a_100000694244_100010074611 [0,1,0,0,0,0|3,0,0]=4 1182 B11R1.166 C=C(C)c1cnc(cc1C)Br 271570a_100000694244_100009816104 [0,1,0,0,0,0|3,0,0]=4 1183 B11R1.166 C=C(C)c1cnc(cc1C)C 271570a_100000694244_100009819613 [0,1,0,0,0,0|2,0,0]=3 1184 B11R1.166 C=C(C)c1cnc(cc1C)Cl 271570a_100000694244_100010172789 [0,1,0,0,0,0|3,0,0]=4 1185 B11R1.166 C=C(C)c1cnc(cc1C)F 271570a_100000694244_100009820716 [0,1,0,0,0,0|3,0,0]=4 1186 B11R1.166 C=C(C)c1cnc(cc1C)N 271570a_100000694244_100000050067 [0,1,0,0,0,0|3,0,0]=4 1187 B11R1.166 C=C(C)c1cnc(cc1C)O 271570a_100000694244_100010114363 [0,1,0,0,0,0|3,0,0]=4 1188 B11R1.166 C=C(C)c1cnc(cc1Cl)Br 271570a_100000694244_100010381092 [0,1,0,0,0,0|3,0,0]=4 1189 B11R1.166 C=C(C)c1cnc(cc1Cl)Cl 271570a_100000694244_100010200927 [0,1,0,0,0,0|3,0,0]=4 1190 B11R1.166 C=C(C)c1cnc(cc1Cl)N 271570a_100000694244_100000694920 [0,1,0,0,0,0|3,0,0]=4 1191 B11R1.166 C=C(C)c1cnc(cc1F)Cl 271570a_100000694244_100010128100 [0,1,0,0,0,0|3,0,0]=4 1192 B11R1.166 C=C(C)c1cnc(cc1F)N 271570a_100000694244_100009844730 [0,1,0,0,0,0|3,0,0]=4 1193 B11R1.166 C=C(C)c1cnc(cc1N)C 271570a_100000694244_100009817891 [0,1,0,0,0,0|2,0,0]=3 1194 B11R1.166 C=C(C)c1cnc(cc1N)N 271570a_100000694244_200009857908 [0,1,0,0,0,0|3,0,0]=4 1195 B11R1.166 C=C(C)c1cnc(cc1O)C 271570a_100000694244_100011016184 [0,1,0,0,0,0|2,0,0]=3 1196 B11R1.166 C=C(C)c1cnc(nc1N)C 271570a_100000694244_100000684960 [0,1,0,0,0,0|3,0,0]=4 1197 B11R1.166 C=C(C)c1ncc(cc1Br)Cl 271570a_100000694244_100012154958 [0,1,0,0,0,0|3,0,0]=4 1198 B11R1.166 C=C(C)c1ncc(cc1C)Br 271570a_100000694244_100012353652 [0,1,0,0,0,0|3,0,0]=4 1199 B11R1.166 C=C(C)c1ncc(cc1C)C 271570a_100000694244_100009864548 [0,1,0,0,0,0|2,0,0]=3 1200 B11R1.166 C=C(C)c1ncc(cc1C)F 271570a_100000694244_100009817009 [0,1,0,0,0,0|3,0,0]=4 1201 B11R1.166 C=C(C)c1ncc(cc1C)N 271570a_100000694244_100000761747 [0,1,0,0,0,0|3,0,0]=4 1202 B11R1.166 C=C(C)c1ncc(cc1C)O 271570a_100000694244_100012000486 [0,1,0,0,0,0|3,0,0]=4 1203 B11R1.166 C=C(C)c1ncc(cc1F)Br 271570a_100000694244_100012348576 [0,1,0,0,0,0|3,0,0]=4 1204 B11R1.166 C=C(C)c1ncc(cc1F)C 271570a_100000694244_100009819633 [0,1,0,0,0,0|2,0,0]=3 1205 B11R1.166 C=C(C)c1ncc(cc1F)Cl 271570a_100000694244_100012348686 [0,1,0,0,0,0|3,0,0]=4 1206 B11R1.166 C=C(C)c1ncc(cc1F)F 271570a_100000694244_100011219543 [0,1,0,0,0,0|3,0,0]=4 1207 B11R1.166 C=C(C)c1ncc(cc1F)N 271570a_100000694244_100010280766 [0,1,0,0,0,0|3,0,0]=4 1208 B11R1.166 C=C(C)c1ncc(cc1F)O 271570a_100000694244_100000063512 [0,1,0,0,0,0|3,0,0]=4 1209 B11R1.166 C=C(C)c1ncc(cc1N)Br 271570a_100000694244_100010090555 [0,1,0,0,0,0|3,0,0]=4 1210 B11R1.166 C=C(C)c1ncc(cc1N)C 271570a_100000694244_100000733613 [0,1,0,0,0,0|2,0,0]=3 1211 B11R1.166 C=C(C)c1ncc(cc1N)F 271570a_100000694244_100009817643 [0,1,0,0,0,0|3,0,0]=4 1212 B11R1.166 C=C(C)c1ncc(cc1N)N 271570a_100000694244_200000093520 [0,1,0,0,0,0|3,0,0]=4 1213 B11R1.166 C=C(C)c1ncc(cc1O)Br 271570a_100000694244_100010210634 [0,1,0,0,0,0|3,0,0]=4 1214 B11R1.166 C=C(C)c1ncc(cc1O)C 271570a_100000694244_100012000487 [0,1,0,0,0,0|2,0,0]=3 1215 B11R1.166 C=C(C)c1ncc(cc1O)Cl 271570a_100000694244_100010233512 [0,1,0,0,0,0|3,0,0]=4 1216 B11R1.166 C=C(C)c1ncc(cc1O)F 271570a_100000694244_100000079967 [0,1,0,0,0,0|3,0,0]=4 1217 B11R1.166 C=C(C)c1ncc(nc1C)C 271570a_100000694244_100000065684 [0,1,0,0,0,0|3,0,0]=4 1218 B11R1.166 CC(=O)c1ccc(cc1Br)Br 1458a_100000762965_200000210301 [0,1,0,0,0,0|1,0,0]=2 1219 B11R1.166 CC(=O)c1ccc(cc1Br)C 1458a_100000685072_200000210301 [0,1,0,0,0,0|0,0,0]=1 1220 B11R1.166 CC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_200000210301 [0,1,0,0,0,0|1,0,0]=2 1221 B11R1.166 CC(=O)c1ccc(cc1Br)F 1458a_100000212304_200000210301 [0,1,0,0,0,0|1,0,0]=2 1222 B11R1.166 CC(=O)c1ccc(cc1Br)I 1458a_100012360512_200000210301 [0,1,0,0,0,0|1,0,0]=2 1223 B11R1.166 CC(=O)c1ccc(cc1Br)O 1458a_100012344906_200000210301 [0,1,0,0,0,0|1,0,0]=2 1224 B11R1.166 CC(=O)c1ccc(cc1C)Br 1458a_100000741311_200000210301 [0,1,0,0,0,0|1,0,0]=2 1225 B11R1.166 CC(=O)c1ccc(cc1C)C 1458a_100000211164_200000210301 [0,1,0,0,0,0|0,0,0]=1 1226 B11R1.166 CC(=O)c1ccc(cc1C)Cl 1458a_100000688705_200000210301 [0,1,0,0,0,0|1,0,0]=2 1227 B11R1.166 CC(=O)c1ccc(cc1C)F 1458a_100000686989_200000210301 [0,1,0,0,0,0|1,0,0]=2 1228 B11R1.166 CC(=O)c1ccc(cc1C)I 1458a_100010189873_200000210301 [0,1,0,0,0,0|1,0,0]=2 1229 B11R1.166 CC(=O)c1ccc(cc1C)O 1458a_100000692822_200000210301 [0,1,0,0,0,0|1,0,0]=2 1230 B11R1.166 CC(=O)c1ccc(cc1C)O 271570a_203496583355_100012360112 [0,1,0,0,0,0|1,0,0]=2 1231 B11R1.166 CC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_200000210301 [0,1,0,0,0,0|1,0,0]=2 1232 B11R1.166 CC(=O)c1ccc(cc1Cl)C 1458a_100000766932_200000210301 [0,1,0,0,0,0|0,0,0]=1 1233 B11R1.166 CC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_200000210301 [0,1,0,0,0,0|1,0,0]=2 1234 B11R1.166 CC(=O)c1ccc(cc1Cl)F 1458a_100000211397_200000210301 [0,1,0,0,0,0|1,0,0]=2 1235 B11R1.166 CC(=O)c1ccc(cc1Cl)I 1458a_100000751301_200000210301 [0,1,0,0,0,0|1,0,0]=2 1236 B11R1.166 CC(=O)c1ccc(cc1Cl)O 1458a_100000702456_200000210301 [0,1,0,0,0,0|1,0,0]=2 1237 B11R1.166 CC(=O)c1ccc(cc1F)Br 1458a_100000214689_200000210301 [0,1,0,0,0,0|1,0,0]=2 1238 B11R1.166 CC(=O)c1ccc(cc1F)C 1458a_100000766033_200000210301 [0,1,0,0,0,0|0,0,0]=1 1239 B11R1.166 CC(=O)c1ccc(cc1F)Cl 1458a_100000212326_200000210301 [0,1,0,0,0,0|1,0,0]=2 1240 B11R1.166 CC(=O)c1ccc(cc1F)F 1458a_100000211022_200000210301 [0,1,0,0,0,0|1,0,0]=2 1241 B11R1.166 CC(=O)c1ccc(cc1F)I 1458a_100000037189_200000210301 [0,1,0,0,0,0|1,0,0]=2 1242 B11R1.166 CC(=O)c1ccc(cc1F)O 1458a_100000689029_200000210301 [0,1,0,0,0,0|1,0,0]=2 1243 B11R1.166 CC(=O)c1ccc(cc1F)O 271570a_203496583355_100000690205 [0,1,0,0,0,0|1,0,0]=2 1244 B11R1.166 CC(=O)c1ccc(cc1I)Br 1458a_100000751167_200000210301 [0,1,0,0,0,0|1,0,0]=2 1245 B11R1.166 CC(=O)c1ccc(cc1I)C 1458a_100009999607_200000210301 [0,1,0,0,0,0|0,0,0]=1 1246 B11R1.166 CC(=O)c1ccc(cc1I)Cl 1458a_100000739380_200000210301 [0,1,0,0,0,0|1,0,0]=2 1247 B11R1.166 CC(=O)c1ccc(cc1I)F 1458a_100000739341_200000210301 [0,1,0,0,0,0|1,0,0]=2 1248 B11R1.166 CC(=O)c1ccc(cc1N)O 271570a_203496583355_100011590516 [0,1,0,0,0,0|1,0,0]=2 1249 B11R1.166 CC(=O)c1ccc(cc1O)Br 1458a_100000744433_200000210301 [0,1,0,0,0,0|1,0,0]=2 1250 B11R1.166 CC(=O)c1ccc(cc1O)C 1458a_100000212137_200000210301 [0,1,0,0,0,0|0,0,0]=1 1251 B11R1.166 CC(=O)c1ccc(cc1O)C 271570a_203496583355_100012353930 [0,1,0,0,0,0|0,0,0]=1 1252 B11R1.166 CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_200000210301 [0,1,0,0,0,0|1,0,0]=2 1253 B11R1.166 CC(=O)c1ccc(cc1O)F 1458a_100000746061_200000210301 [0,1,0,0,0,0|1,0,0]=2 1254 B11R1.166 CC(=O)c1ccc(cc1O)F 271570a_203496583355_100000686192 [0,1,0,0,0,0|1,0,0]=2 1255 B11R1.166 CC(=O)c1ccc(cc1O)I 1458a_100000091984_200000210301 [0,1,0,0,0,0|1,0,0]=2 1256 B11R1.166 CC(=O)c1ccc(cc1O)O 1458a_100000212172_200000210301 [0,1,0,0,0,0|1,0,0]=2 1257 B11R1.166 CC(=O)c1ccc(cc1O)O 271570a_203496583355_100000188348 [0,1,0,0,0,0|1,0,0]=2 1258 B11R1.166 CC(=O)c1ccc(cc1O)O 271570a_203496583355_100012340537 [0,1,0,0,0,0|1,0,0]=2 1259 B11R1.166 CC(=O)c1ncc(cc1F)O 271570a_203496583355_100000696590 [0,1,0,0,0,0|2,0,0]=3 1260 B11R1.166 CC(N)c1ccc(cc1F)O 271570a_203496583355_100000730447 [0,1,0,0,0,0|2,0,1]=4 1261 B11R1.166 CN(C)c1ccc(cc1Br)Br 269982a_200000221195_200000210301 [0,1,0,0,0,0|3,0,0]=4 1262 B11R1.166 CN(C)c1ccc(cc1Br)Br 34a_200000221195_200000210301 [0,1,0,0,0,0|3,0,0]=4 1263 B11R1.166 CN(C)c1ccc(cc1Br)Cl 269982a_100020633009_200000210301 [0,1,0,0,0,0|3,0,0]=4 1264 B11R1.166 CN(C)c1ccc(cc1Br)Cl 34a_100020633009_200000210301 [0,1,0,0,0,0|3,0,0]=4 1265 B11R1.166 CN(C)c1ccc(cc1Br)F 269982a_100011246292_200000210301 [0,1,0,0,0,0|3,0,0]=4 1266 B11R1.166 CN(C)c1ccc(cc1Br)F 34a_100011246292_200000210301 [0,1,0,0,0,0|3,0,0]=4 1267 B11R1.166 CN(C)c1ccc(cc1Cl)Br 269982a_100000221650_200000210301 [0,1,0,0,0,0|3,0,0]=4 1268 B11R1.166 CN(C)c1ccc(cc1Cl)Br 34a_100000221650_200000210301 [0,1,0,0,0,0|3,0,0]=4 1269 B11R1.166 CN(C)c1ccc(cc1Cl)Cl 269982a_114849113696_200000210301 [0,1,0,0,0,0|3,0,0]=4 1270 B11R1.166 CN(C)c1ccc(cc1Cl)Cl 34a_114849113696_200000210301 [0,1,0,0,0,0|3,0,0]=4 1271 B11R1.166 CN(C)c1ccc(cc1F)Br 2230a_100000743884_200000210301 [0,1,0,0,0,0|3,0,0]=4 1272 B11R1.166 CN(C)c1ccc(cc1F)Br 269982a_100000743884_200000210301 [0,1,0,0,0,0|3,0,0]=4 1273 B11R1.166 CN(C)c1ccc(cc1F)Br 34a_100000743884_200000210301 [0,1,0,0,0,0|3,0,0]=4 1274 B11R1.166 CN(C)c1ccc(cc1F)F 2230a_100020633734_200000210301 [0,1,0,0,0,0|3,0,0]=4 1275 B11R1.166 CN(C)c1ccc(cc1F)F 269982a_100020633734_200000210301 [0,1,0,0,0,0|3,0,0]=4 1276 B11R1.166 CN(C)c1ccc(cc1F)F 34a_100020633734_200000210301 [0,1,0,0,0,0|3,0,0]=4 1277 B11R1.166 CN(C)c1ccc(cc1F)F 38a_100020633734_200000210301 [0,1,0,0,0,0|3,0,0]=4 1278 B11R1.166 CN(C)c1ccc(cc1F)I 269982a_114948340911_200000210301 [0,1,0,0,0,0|3,0,0]=4 1279 B11R1.166 CN(C)c1ccc(cc1F)I 34a_114948340911_200000210301 [0,1,0,0,0,0|3,0,0]=4 1280 B11R1.166 CN(C)c1ccc(cc1F)I 38a_114948340911_200000210301 [0,1,0,0,0,0|3,0,0]=4 1281 B11R1.166 CN(C)c1ccc(cc1N)O 271570a_203496583355_100000737018 [0,1,0,0,0,0|3,0,0]=4 1282 B11R1.166 CN(C)c1ccc(cc1O)F 271570a_203496583355_100012349029 [0,1,0,0,0,0|3,0,0]=4 1283 B11R1.166 CN(C)c1ccc(cc1O)N 271570a_203496583355_100011534197 [0,1,0,0,0,0|3,0,0]=4 1284 B11R1.166 CN([13CH3])c1ccc(cc1Br)Br 269982a_200000221195_200025704644 [0,1,0,0,0,0|3,0,0]=4 1285 B11R1.166 CN([13CH3])c1ccc(cc1Br)Br 34a_200000221195_200025704644 [0,1,0,0,0,0|3,0,0]=4 1286 B11R1.166 CN([13CH3])c1ccc(cc1Br)Cl 269982a_100020633009_200025704644 [0,1,0,0,0,0|3,0,0]=4 1287 B11R1.166 CN([13CH3])c1ccc(cc1Br)Cl 34a_100020633009_200025704644 [0,1,0,0,0,0|3,0,0]=4 1288 B11R1.166 CN([13CH3])c1ccc(cc1Br)F 269982a_100011246292_200025704644 [0,1,0,0,0,0|3,0,0]=4 1289 B11R1.166 CN([13CH3])c1ccc(cc1Br)F 34a_100011246292_200025704644 [0,1,0,0,0,0|3,0,0]=4 1290 B11R1.166 CN([13CH3])c1ccc(cc1Cl)Br 269982a_100000221650_200025704644 [0,1,0,0,0,0|3,0,0]=4 1291 B11R1.166 CN([13CH3])c1ccc(cc1Cl)Br 34a_100000221650_200025704644 [0,1,0,0,0,0|3,0,0]=4 1292 B11R1.166 CN([13CH3])c1ccc(cc1Cl)Cl 269982a_114849113696_200025704644 [0,1,0,0,0,0|3,0,0]=4 1293 B11R1.166 CN([13CH3])c1ccc(cc1Cl)Cl 34a_114849113696_200025704644 [0,1,0,0,0,0|3,0,0]=4 1294 B11R1.166 CN([13CH3])c1ccc(cc1F)Br 2230a_100000743884_200025704644 [0,1,0,0,0,0|3,0,0]=4 1295 B11R1.166 CN([13CH3])c1ccc(cc1F)Br 269982a_100000743884_200025704644 [0,1,0,0,0,0|3,0,0]=4 1296 B11R1.166 CN([13CH3])c1ccc(cc1F)Br 34a_100000743884_200025704644 [0,1,0,0,0,0|3,0,0]=4 1297 B11R1.166 CN([13CH3])c1ccc(cc1F)F 2230a_100020633734_200025704644 [0,1,0,0,0,0|3,0,0]=4 1298 B11R1.166 CN([13CH3])c1ccc(cc1F)F 269982a_100020633734_200025704644 [0,1,0,0,0,0|3,0,0]=4 1299 B11R1.166 CN([13CH3])c1ccc(cc1F)F 34a_100020633734_200025704644 [0,1,0,0,0,0|3,0,0]=4 1300 B11R1.166 CN([13CH3])c1ccc(cc1F)F 38a_100020633734_200025704644 [0,1,0,0,0,0|3,0,0]=4 1301 B11R1.166 CN([13CH3])c1ccc(cc1F)I 269982a_114948340911_200025704644 [0,1,0,0,0,0|3,0,0]=4 1302 B11R1.166 CN([13CH3])c1ccc(cc1F)I 34a_114948340911_200025704644 [0,1,0,0,0,0|3,0,0]=4 1303 B11R1.166 CN([13CH3])c1ccc(cc1F)I 38a_114948340911_200025704644 [0,1,0,0,0,0|3,0,0]=4 1304 B11R1.166 C[C@@H](N)c1ccc(cc1O)F 271570a_203496583355_100025704064 [0,1,0,0,0,0|2,0,1]=4 1305 B11R1.166 Cc1cc(ccc1C(=O)N)O 271570a_203496583355_100011327924 [0,1,0,0,0,0|2,0,0]=3 1306 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])Br 1458a_100000741311_200025704644 [0,1,0,0,0,0|1,0,0]=2 1307 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])Cl 1458a_100000688705_200025704644 [0,1,0,0,0,0|1,0,0]=2 1308 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])F 1458a_100000686989_200025704644 [0,1,0,0,0,0|1,0,0]=2 1309 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])I 1458a_100010189873_200025704644 [0,1,0,0,0,0|1,0,0]=2 1310 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])O 1458a_100000692822_200025704644 [0,1,0,0,0,0|1,0,0]=2 1311 B11R1.166 Cc1cc(ccc1N(C)C)Br 2230a_100000221803_200000210301 [0,1,0,0,0,0|3,0,0]=4 1312 B11R1.166 Cc1cc(ccc1N(C)C)Br 269982a_100000221803_200000210301 [0,1,0,0,0,0|3,0,0]=4 1313 B11R1.166 Cc1cc(ccc1N(C)C)Br 34a_100000221803_200000210301 [0,1,0,0,0,0|3,0,0]=4 1314 B11R1.166 Cc1cc(ccc1N(C)C)Cl 2230a_114849113698_200000210301 [0,1,0,0,0,0|3,0,0]=4 1315 B11R1.166 Cc1cc(ccc1N(C)C)Cl 269982a_114849113698_200000210301 [0,1,0,0,0,0|3,0,0]=4 1316 B11R1.166 Cc1cc(ccc1N(C)C)Cl 34a_114849113698_200000210301 [0,1,0,0,0,0|3,0,0]=4 1317 B11R1.166 Cc1cc(ccc1N(C)C)Cl 38a_114849113698_200000210301 [0,1,0,0,0,0|3,0,0]=4 1318 B11R1.166 Cc1cc(ccc1N(C)C)O 269982a_100161107805_200000210301 [0,1,0,0,0,0|3,0,0]=4 1319 B11R1.166 Cc1cc(ccc1N(C)C)O 34a_100161107805_200000210301 [0,1,0,0,0,0|3,0,0]=4 1320 B11R1.166 Cc1cc(ccc1N(C)[13CH3])Br 2230a_100000221803_200025704644 [0,1,0,0,0,0|3,0,0]=4 1321 B11R1.166 Cc1cc(ccc1N(C)[13CH3])Br 269982a_100000221803_200025704644 [0,1,0,0,0,0|3,0,0]=4 1322 B11R1.166 Cc1cc(ccc1N(C)[13CH3])Br 34a_100000221803_200025704644 [0,1,0,0,0,0|3,0,0]=4 1323 B11R1.166 Cc1cc(ccc1N(C)[13CH3])Cl 2230a_114849113698_200025704644 [0,1,0,0,0,0|3,0,0]=4 1324 B11R1.166 Cc1cc(ccc1N(C)[13CH3])Cl 269982a_114849113698_200025704644 [0,1,0,0,0,0|3,0,0]=4 1325 B11R1.166 Cc1cc(ccc1N(C)[13CH3])Cl 34a_114849113698_200025704644 [0,1,0,0,0,0|3,0,0]=4 1326 B11R1.166 Cc1cc(ccc1N(C)[13CH3])Cl 38a_114849113698_200025704644 [0,1,0,0,0,0|3,0,0]=4 1327 B11R1.166 Cc1cc(ccc1N(C)[13CH3])O 269982a_100161107805_200025704644 [0,1,0,0,0,0|3,0,0]=4 1328 B11R1.166 Cc1cc(ccc1N(C)[13CH3])O 34a_100161107805_200025704644 [0,1,0,0,0,0|3,0,0]=4 1329 B11R1.166 Cc1cc(ncc1C(=O)N)O 271570a_203496583355_200134614278 [0,1,0,0,0,0|3,0,0]=4 1330 B11R1.166 Cc1ccc(c(c1)Br)C(=O)[13CH3] 1458a_100000685072_200025704644 [0,1,0,0,0,0|0,0,0]=1 1331 B11R1.166 Cc1ccc(c(c1)Br)N(C)C 2230a_100000221369_200000210301 [0,1,0,0,0,0|2,0,0]=3 1332 B11R1.166 Cc1ccc(c(c1)Br)N(C)C 269982a_100000221369_200000210301 [0,1,0,0,0,0|2,0,0]=3 1333 B11R1.166 Cc1ccc(c(c1)Br)N(C)C 34a_100000221369_200000210301 [0,1,0,0,0,0|2,0,0]=3 1334 B11R1.166 Cc1ccc(c(c1)Br)N(C)[13CH3] 2230a_100000221369_200025704644 [0,1,0,0,0,0|2,0,0]=3 1335 B11R1.166 Cc1ccc(c(c1)Br)N(C)[13CH3] 269982a_100000221369_200025704644 [0,1,0,0,0,0|2,0,0]=3 1336 B11R1.166 Cc1ccc(c(c1)Br)N(C)[13CH3] 34a_100000221369_200025704644 [0,1,0,0,0,0|2,0,0]=3 1337 B11R1.166 Cc1ccc(c(c1)C)C(=O)[13CH3] 1458a_100000211164_200025704644 [0,1,0,0,0,0|0,0,0]=1 1338 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)[13CH3] 1458a_100000766932_200025704644 [0,1,0,0,0,0|0,0,0]=1 1339 B11R1.166 Cc1ccc(c(c1)F)C(=O)[13CH3] 1458a_100000766033_200025704644 [0,1,0,0,0,0|0,0,0]=1 1340 B11R1.166 Cc1ccc(c(c1)I)C(=O)[13CH3] 1458a_100009999607_200025704644 [0,1,0,0,0,0|0,0,0]=1 1341 B11R1.166 Cc1ccc(c(c1)O)B(O)O 271570a_203496583355_200011068827 [0,1,0,0,0,0|2,0,1]=4 1342 B11R1.166 Cc1ccc(c(c1)O)C(=O)[13CH3] 1458a_100000212137_200025704644 [0,1,0,0,0,0|0,0,0]=1 1343 B11R1.166 Cc1ccc(c(c1)O)N(C)C 271570a_203496583355_100012353700 [0,1,0,0,0,0|2,0,0]=3 1344 B11R1.166 Cc1ccc(c(n1)O)C(=O)N 271570a_203496583355_100000041523 [0,1,0,0,0,0|2,0,0]=3 1345 B11R1.166 NC(=O)c1ccc(cc1Br)O 271570a_203496583355_200010146565 [0,1,0,0,0,0|2,0,0]=3 1346 B11R1.166 NC(=O)c1ccc(cc1F)O 271570a_203496583355_100000216903 [0,1,0,0,0,0|2,0,0]=3 1347 B11R1.166 NC(=O)c1ccc(cc1N)O 271570a_203496583355_100012349972 [0,1,0,0,0,0|2,0,0]=3 1348 B11R1.166 NC(=O)c1ccc(cc1O)Br 271570a_203496583355_100009815748 [0,1,0,0,0,0|2,0,0]=3 1349 B11R1.166 NC(=O)c1ccc(cc1O)F 271570a_203496583355_100000206404 [0,1,0,0,0,0|2,0,0]=3 1350 B11R1.166 NC(=O)c1ccc(cc1O)O 271570a_203496583355_100011550861 [0,1,0,0,0,0|2,0,0]=3 1351 B11R1.166 NC(=O)c1ccc(nc1N)O 271570a_203496583355_100009875182 [0,1,0,0,0,0|3,0,0]=4 1352 B11R1.166 NC(=O)c1ncc(cc1F)O 271570a_203496583355_200010161073 [0,1,0,0,0,0|3,0,0]=4 1353 B11R1.166 NC(=O)c1ncc(cc1N)O 271570a_203496583355_100010235749 [0,1,0,0,0,0|3,0,0]=4 1354 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)Br 1458a_100000762965_200025704644 [0,1,0,0,0,0|1,0,0]=2 1355 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)Cl 1458a_100000766353_200025704644 [0,1,0,0,0,0|1,0,0]=2 1356 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)F 1458a_100000212304_200025704644 [0,1,0,0,0,0|1,0,0]=2 1357 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)I 1458a_100012360512_200025704644 [0,1,0,0,0,0|1,0,0]=2 1358 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)O 1458a_100012344906_200025704644 [0,1,0,0,0,0|1,0,0]=2 1359 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)Br 1458a_100000741628_200025704644 [0,1,0,0,0,0|1,0,0]=2 1360 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_200025704644 [0,1,0,0,0,0|1,0,0]=2 1361 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)F 1458a_100000211397_200025704644 [0,1,0,0,0,0|1,0,0]=2 1362 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)I 1458a_100000751301_200025704644 [0,1,0,0,0,0|1,0,0]=2 1363 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)O 1458a_100000702456_200025704644 [0,1,0,0,0,0|1,0,0]=2 1364 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)Br 1458a_100000214689_200025704644 [0,1,0,0,0,0|1,0,0]=2 1365 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)Cl 1458a_100000212326_200025704644 [0,1,0,0,0,0|1,0,0]=2 1366 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)F 1458a_100000211022_200025704644 [0,1,0,0,0,0|1,0,0]=2 1367 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)I 1458a_100000037189_200025704644 [0,1,0,0,0,0|1,0,0]=2 1368 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)O 1458a_100000689029_200025704644 [0,1,0,0,0,0|1,0,0]=2 1369 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)Br 1458a_100000751167_200025704644 [0,1,0,0,0,0|1,0,0]=2 1370 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)Cl 1458a_100000739380_200025704644 [0,1,0,0,0,0|1,0,0]=2 1371 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)F 1458a_100000739341_200025704644 [0,1,0,0,0,0|1,0,0]=2 1372 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)Br 1458a_100000744433_200025704644 [0,1,0,0,0,0|1,0,0]=2 1373 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)Cl 1458a_100000188622_200025704644 [0,1,0,0,0,0|1,0,0]=2 1374 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)F 1458a_100000746061_200025704644 [0,1,0,0,0,0|1,0,0]=2 1375 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)I 1458a_100000091984_200025704644 [0,1,0,0,0,0|1,0,0]=2 1376 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)O 1458a_100000212172_200025704644 [0,1,0,0,0,0|1,0,0]=2 1377 B9R0.1 C/C=C(\C)/C=NNC(=O)C 4a_100000189765_100020587592 [0,0,1,0,0,0|2,0,1]=4 1378 B9R0.1 CC(=O)NN=C/C(=C\N)/C 4a_100000189765_100050415766 [0,0,1,0,0,0|3,0,0]=4 1379 B11R2.34 Brc1ccc(cc1)C2CC2 271570a_100011220607_100000752885 [0,0,0,1,0,0|2,0,1]=4 1380 B11R2.34 Cc1ccc(cc1)C2CC2 271570a_100011220607_100000186775 [0,0,0,1,0,0|1,0,1]=3 1381 B11R2.34 Cc1ccc(cn1)C2CC2 271570a_100011220607_100000751577 [0,0,0,1,0,0|2,0,1]=4 1382 B11R2.34 Cc1ccc(nc1)C2CC2 271570a_100011220607_100000754016 [0,0,0,1,0,0|2,0,1]=4 1383 B11R2.34 Clc1ccc(cc1)C2CC2 271570a_100011220607_100000755918 [0,0,0,1,0,0|2,0,1]=4 1384 B11R2.34 Fc1ccc(cc1)C2CC2 271570a_100011220607_100000211213 [0,0,0,1,0,0|2,0,1]=4 1385 B11R2.34 Nc1ccc(cc1)C2CC2 271570a_100011220607_100000185761 [0,0,0,1,0,0|2,0,1]=4 1386 B11R2.34 Oc1ccc(cc1)C2CC2 271570a_100011220607_100000185759 [0,0,0,1,0,0|2,0,1]=4 1387 B11R2.34 Oc1ccc(cc1)C2CC2 271570a_203496583355_100009820665 [0,0,0,1,0,0|2,0,1]=4 1388 B9R1.35 C=C(C)c1c[nH]c(n1)C 271570a_100000694244_100009814057 [0,0,0,0,1,0|3,0,0]=4 1389 B9R1.35 C=C(C)c1cc([nH]n1)C 271570a_100000694244_100015199547 [0,0,0,0,1,0|3,0,0]=4 1390 B9R1.35 C=C(C)c1cc(cs1)C 271570a_100000694244_100009876951 [0,0,0,0,1,0|2,0,0]=3 1391 B9R1.35 C=C(C)c1cc(ns1)C 271570a_100000694244_100009815735 [0,0,0,0,1,0|3,0,0]=4 1392 B9R1.35 C=C(C)c1ccc(s1)Br 271570a_100000694244_100010197418 [0,0,0,0,1,0|3,0,0]=4 1393 B9R1.35 C=C(C)c1ccc(s1)C 271570a_100000694244_100000761539 [0,0,0,0,1,0|2,0,0]=3 1394 B9R1.35 C=C(C)c1ccn(n1)C 271570a_100000694244_100000752436 [0,0,0,0,1,0|3,0,0]=4 1395 B9R1.35 C=C(C)c1cn(cn1)C 271570a_100000694244_100000040308 [0,0,0,0,1,0|3,0,0]=4 1396 B9R1.35 C=C(C)c1cnc(s1)C 271570a_100000694244_100000764884 [0,0,0,0,1,0|3,0,0]=4 1397 B9R1.35 C=C(C)c1cnn(c1)C 271570a_100000694244_100000748075 [0,0,0,0,1,0|3,0,0]=4 1398 B9R1.35 C=C(C)c1csc(c1)C 271570a_100000694244_100000759034 [0,0,0,0,1,0|2,0,0]=3 1399 B9R1.35 C=C(C)c1csc(n1)C 271570a_100000694244_100011934587 [0,0,0,0,1,0|3,0,0]=4 1400 B9R1.35 C=C(C)c1nc(c[nH]1)C 271570a_100000694244_100161115468 [0,0,0,0,1,0|3,0,0]=4 1401 B9R1.35 C=C(C)c1nc(cs1)C 271570a_100000694244_100011291629 [0,0,0,0,1,0|3,0,0]=4 1402 B9R1.35 C=C(C)c1ncc(s1)C 271570a_100000694244_100000690809 [0,0,0,0,1,0|3,0,0]=4 1403 B9R1.35 CC(=O)c1cc(cs1)O 271570a_203496583355_100000718618 [0,0,0,0,1,0|2,0,0]=3 1404 B9R1.35 CC(=O)c1ccc([nH]1)O 271570a_203496583355_200010494458 [0,0,0,0,1,0|2,0,0]=3 1405 B9R1.35 CC(=O)c1ccc(o1)O 271570a_203496583355_100000229899 [0,0,0,0,1,0|2,0,0]=3 1406 B9R1.35 CC(=O)c1ccc(s1)O 271570a_203496583355_100000183331 [0,0,0,0,1,0|2,0,0]=3 1407 B9R1.35 CC(=O)c1cn(nn1)C 274090a_200000210301_100000690481 [0,0,0,0,1,0|3,0,0]=4 1408 B9R1.35 CC(=O)c1cn(nn1)[13CH3] 274090a_200025704644_100000690481 [0,0,0,0,1,0|3,0,0]=4 1409 B9R1.35 CC(=O)c1cnc(s1)O 271570a_203496583355_200010173910 [0,0,0,0,1,0|3,0,0]=4 1410 B9R1.35 CC(=O)c1csc(c1)O 271570a_203496583355_200012344231 [0,0,0,0,1,0|2,0,0]=3 1411 B9R1.35 CC(=O)c1nc(cs1)O 271570a_203496583355_100010231720 [0,0,0,0,1,0|3,0,0]=4 1412 B9R1.35 CC(=O)c1ncc(s1)O 271570a_203496583355_100000693680 [0,0,0,0,1,0|3,0,0]=4 1413 B9R1.35 CC(=O)n1cc(cn1)O 271570a_203496583355_100010205889 [0,0,0,0,1,0|3,0,0]=4 1414 B9R1.35 NC(=O)c1cc(c[nH]1)O 271570a_203496583355_100000229580 [0,0,0,0,1,0|3,0,0]=4 1415 B9R1.35 NC(=O)c1cc(co1)O 271570a_203496583355_200009817131 [0,0,0,0,1,0|3,0,0]=4 1416 B9R1.35 NC(=O)c1cc(cs1)O 271570a_203496583355_100009812991 [0,0,0,0,1,0|3,0,0]=4 1417 B9R1.35 NC(=O)c1ccc(s1)O 271570a_203496583355_100000162267 [0,0,0,0,1,0|3,0,0]=4 1418 B9R1.35 NC(=O)c1csc(c1)O 271570a_203496583355_100000747962 [0,0,0,0,1,0|3,0,0]=4 1419 B11R1.20 CC(=Cc1cc[n+](cc1)[O-])C 271570a_100102525489_100000039755 [0,0,0,0,0,1|3,0,0]=4 1420 B11R1.20 CC(=Cc1ccc(=O)[nH]c1)C 271570a_100102525489_100000212171 [0,0,0,0,0,1|3,0,0]=4 1421 B11R1.20 CC(=Cc1ccc(cc1)Br)C 271570a_100102525489_100000752885 [0,0,0,0,0,1|2,0,0]=3 1422 B11R1.20 CC(=Cc1ccc(cc1)C)C 271570a_100102525489_100000186775 [0,0,0,0,0,1|1,0,0]=2 1423 B11R1.20 CC(=Cc1ccc(cc1)Cl)C 271570a_100102525489_100000755918 [0,0,0,0,0,1|2,0,0]=3 1424 B11R1.20 CC(=Cc1ccc(cc1)F)C 271570a_100102525489_100000211213 [0,0,0,0,0,1|2,0,0]=3 1425 B11R1.20 CC(=Cc1ccc(cc1)N)C 271570a_100102525489_100000185761 [0,0,0,0,0,1|2,0,0]=3 1426 B11R1.20 CC(=Cc1ccc(cc1)O)C 271570a_100102525489_100000185759 [0,0,0,0,0,1|2,0,0]=3 1427 B11R1.20 CC(=Cc1ccc(cn1)Br)C 271570a_100102525489_100000686858 [0,0,0,0,0,1|3,0,0]=4 1428 B11R1.20 CC(=Cc1ccc(cn1)C)C 271570a_100102525489_100000754016 [0,0,0,0,0,1|2,0,0]=3 1429 B11R1.20 CC(=Cc1ccc(cn1)Cl)C 271570a_100102525489_100011356976 [0,0,0,0,0,1|3,0,0]=4 1430 B11R1.20 CC(=Cc1ccc(cn1)F)C 271570a_100102525489_100000744514 [0,0,0,0,0,1|3,0,0]=4 1431 B11R1.20 CC(=Cc1ccc(cn1)N)C 271570a_100102525489_100000744251 [0,0,0,0,0,1|3,0,0]=4 1432 B11R1.20 CC(=Cc1ccc(cn1)O)C 271570a_100102525489_100000685995 [0,0,0,0,0,1|3,0,0]=4 1433 B11R1.20 CC(=Cc1ccc(nc1)Br)C 271570a_100102525489_100009814638 [0,0,0,0,0,1|3,0,0]=4 1434 B11R1.20 CC(=Cc1ccc(nc1)C)C 271570a_100102525489_100000751577 [0,0,0,0,0,1|2,0,0]=3 1435 B11R1.20 CC(=Cc1ccc(nc1)Cl)C 271570a_100102525489_100000034144 [0,0,0,0,0,1|3,0,0]=4 1436 B11R1.20 CC(=Cc1ccc(nc1)F)C 271570a_100102525489_100000748661 [0,0,0,0,0,1|3,0,0]=4 1437 B11R1.20 CC(=Cc1ccc(nc1)N)C 271570a_100102525489_100000187370 [0,0,0,0,0,1|3,0,0]=4 1438 B11R1.20 CC(=Cc1ccc(nn1)C)C 271570a_100102525489_100011450037 [0,0,0,0,0,1|3,0,0]=4 1439 B11R1.20 CC(=Cc1cnc(cn1)C)C 271570a_100102525489_100011999403 [0,0,0,0,0,1|3,0,0]=4 1440 B11R1.20 CC(=Cc1cnc(nc1)C)C 271570a_100102525489_100000686985 [0,0,0,0,0,1|3,0,0]=4 1441 B11R1.20 CC(=Cc1ncc(cn1)C)C 271570a_100102525489_100011825175 [0,0,0,0,0,1|3,0,0]=4 1442 B11R1.20 CC(=O)Cc1ccc(cc1)Br 1458a_100000070787_100000189115 [0,0,0,0,0,1|1,0,0]=2 1443 B11R1.20 CC(=O)Cc1ccc(cc1)Br 1458a_100000198978_200000210301 [0,0,0,0,0,1|1,0,0]=2 1444 B11R1.20 CC(=O)Cc1ccc(cc1)C 1458a_100000070787_100000210814 [0,0,0,0,0,1|0,0,0]=1 1445 B11R1.20 CC(=O)Cc1ccc(cc1)C 1458a_100000212244_200000210301 [0,0,0,0,0,1|0,0,0]=1 1446 B11R1.20 CC(=O)Cc1ccc(cc1)Cl 1458a_100000070787_100000694040 [0,0,0,0,0,1|1,0,0]=2 1447 B11R1.20 CC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_200000210301 [0,0,0,0,0,1|1,0,0]=2 1448 B11R1.20 CC(=O)Cc1ccc(cc1)F 1458a_100000070787_100000198546 [0,0,0,0,0,1|1,0,0]=2 1449 B11R1.20 CC(=O)Cc1ccc(cc1)F 1458a_100000210951_200000210301 [0,0,0,0,0,1|1,0,0]=2 1450 B11R1.20 CC(=O)Cc1ccc(cc1)I 1458a_100000070787_100000189116 [0,0,0,0,0,1|1,0,0]=2 1451 B11R1.20 CC(=O)Cc1ccc(cc1)I 1458a_100000688869_200000210301 [0,0,0,0,0,1|1,0,0]=2 1452 B11R1.20 CC(=O)Cc1ccc(cc1)O 1458a_100000198540_200000210301 [0,0,0,0,0,1|1,0,0]=2 1453 B11R1.20 CC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000691760 [0,0,0,0,0,1|1,0,0]=2 1454 B11R1.20 CC(=O)Cc1ccc(cn1)Br 1458a_100000070787_100000702658 [0,0,0,0,0,1|2,0,0]=3 1455 B11R1.20 CC(=O)Cc1ccc(cn1)Br 1458a_100020629044_200000210301 [0,0,0,0,0,1|2,0,0]=3 1456 B11R1.20 CC(=O)Cc1ccc(cn1)C 1458a_100000070787_100000691093 [0,0,0,0,0,1|1,0,0]=2 1457 B11R1.20 CC(=O)Cc1ccc(cn1)C 1458a_100025705728_200000210301 [0,0,0,0,0,1|1,0,0]=2 1458 B11R1.20 CC(=O)Cc1ccc(cn1)Cl 1458a_100000070787_100012066911 [0,0,0,0,0,1|2,0,0]=3 1459 B11R1.20 CC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_200000210301 [0,0,0,0,0,1|2,0,0]=3 1460 B11R1.20 CC(=O)Cc1ccc(cn1)F 1458a_100000070787_100000703193 [0,0,0,0,0,1|2,0,0]=3 1461 B11R1.20 CC(=O)Cc1ccc(nc1)Br 1458a_100000070787_100009831999 [0,0,0,0,0,1|2,0,0]=3 1462 B11R1.20 CC(=O)Cc1ccc(nc1)Br 1458a_100010067268_200000210301 [0,0,0,0,0,1|2,0,0]=3 1463 B11R1.20 CC(=O)Cc1ccc(nc1)C 1458a_100000070787_100016987292 [0,0,0,0,0,1|1,0,0]=2 1464 B11R1.20 CC(=O)Cc1ccc(nc1)C 1458a_100000740413_200000210301 [0,0,0,0,0,1|1,0,0]=2 1465 B11R1.20 CC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_200000210301 [0,0,0,0,0,1|2,0,0]=3 1466 B11R1.20 CC(=O)Cc1ccc(nc1)Cl 1458a_100000070787_100000735431 [0,0,0,0,0,1|2,0,0]=3 1467 B11R1.20 CC(=O)Cc1ccc(nc1)F 1458a_100000070787_100009820150 [0,0,0,0,0,1|2,0,0]=3 1468 B11R1.20 CC(=O)Cc1ccc(nn1)Cl 1458a_100000070787_100016992710 [0,0,0,0,0,1|3,0,0]=4 1469 B11R1.20 CC(=O)Cc1cnc(cn1)C 1458a_100000070787_100000752025 [0,0,0,0,0,1|2,0,0]=3 1470 B11R1.20 CC(=O)Cc1ncc(cn1)Br 1458a_100000070787_100010064664 [0,0,0,0,0,1|3,0,0]=4 1471 B11R1.20 CC(=O)Cc1ncc(cn1)C 1458a_100000070787_100000685645 [0,0,0,0,0,1|2,0,0]=3 1472 B11R1.20 CC(=O)Cn1ccc(=O)cc1 1458a_200000238563_200000210301 [0,0,0,0,0,1|2,0,0]=3 1473 B11R1.20 CC(=O)Nc1ccc(cc1)Br 11a_100000210018_100015343762 [0,0,0,0,0,1|1,0,0]=2 1474 B11R1.20 CC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100015343762 [0,0,0,0,0,1|1,0,0]=2 1475 B11R1.20 CC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000070787 [0,0,0,0,0,1|1,0,0]=2 1476 B11R1.20 CC(=O)Nc1ccc(cc1)Br 527a_100000210018_100103153847 [0,0,0,0,0,1|1,0,0]=2 1477 B11R1.20 CC(=O)Nc1ccc(cc1)C 11a_100000124888_100015343762 [0,0,0,0,0,1|0,0,0]=1 1478 B11R1.20 CC(=O)Nc1ccc(cc1)C 1626a_100000124888_100015343762 [0,0,0,0,0,1|0,0,0]=1 1479 B11R1.20 CC(=O)Nc1ccc(cc1)C 22a_100000124888_100000070787 [0,0,0,0,0,1|0,0,0]=1 1480 B11R1.20 CC(=O)Nc1ccc(cc1)C 527a_100000124888_100103153847 [0,0,0,0,0,1|0,0,0]=1 1481 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100015343762 [0,0,0,0,0,1|1,0,0]=2 1482 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100015343762 [0,0,0,0,0,1|1,0,0]=2 1483 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000070787 [0,0,0,0,0,1|1,0,0]=2 1484 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100103153847 [0,0,0,0,0,1|1,0,0]=2 1485 B11R1.20 CC(=O)Nc1ccc(cc1)F 11a_100000185862_100015343762 [0,0,0,0,0,1|1,0,0]=2 1486 B11R1.20 CC(=O)Nc1ccc(cc1)F 1626a_100000185862_100015343762 [0,0,0,0,0,1|1,0,0]=2 1487 B11R1.20 CC(=O)Nc1ccc(cc1)F 22a_100000185862_100000070787 [0,0,0,0,0,1|1,0,0]=2 1488 B11R1.20 CC(=O)Nc1ccc(cc1)F 527a_100000185862_100103153847 [0,0,0,0,0,1|1,0,0]=2 1489 B11R1.20 CC(=O)Nc1ccc(cc1)I 11a_100000185761_100015343762 [0,0,0,0,0,1|1,0,0]=2 1490 B11R1.20 CC(=O)Nc1ccc(cc1)I 1626a_100000185761_100015343762 [0,0,0,0,0,1|1,0,0]=2 1491 B11R1.20 CC(=O)Nc1ccc(cc1)I 22a_100000185761_100000070787 [0,0,0,0,0,1|1,0,0]=2 1492 B11R1.20 CC(=O)Nc1ccc(cc1)I 527a_100000185761_100103153847 [0,0,0,0,0,1|1,0,0]=2 1493 B11R1.20 CC(=O)Nc1ccc(cc1)O 22a_100000185829_100000070787 [0,0,0,0,0,1|1,0,0]=2 1494 B11R1.20 CC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000155215 [0,0,0,0,0,1|1,0,0]=2 1495 B11R1.20 CC(=O)Nc1ccc(cn1)O 271570a_203496583355_100000193312 [0,0,0,0,0,1|2,0,0]=3 1496 B11R1.20 CC(=O)Nc1ccc(nc1)O 271570a_203496583355_100011934715 [0,0,0,0,0,1|2,0,0]=3 1497 B11R1.20 CC(=O)Nc1ccc(nn1)O 271570a_203496583355_100011804224 [0,0,0,0,0,1|3,0,0]=4 1498 B11R1.20 CC(=O)Nc1ncc(cn1)O 271570a_203496583355_100010141023 [0,0,0,0,0,1|3,0,0]=4 1499 B11R1.20 CC(=O)Oc1ccc(cc1)O 271570a_203496583355_100000002173 [0,0,0,0,0,1|1,0,0]=2 1500 B11R1.20 CC(=O)Sc1ccc(cc1)O 271570a_203496583355_200009995050 [0,0,0,0,0,1|1,0,0]=2 1501 B11R1.20 CC(=S)Oc1ccc(cc1)O 271570a_203496583355_200009816735 [0,0,0,0,0,1|1,1,0]=3 1502 B11R1.20 CC(C)Cc1ccc(cc1)O 271570a_203496583355_100011221366 [0,0,0,0,0,1|2,0,1]=4 1503 B11R1.20 CC(C)Nc1ccc(cc1)Br 2230a_100000210018_100000210206 [0,0,0,0,0,1|2,0,1]=4 1504 B11R1.20 CC(C)Nc1ccc(cc1)Br 34a_100000210018_100000210206 [0,0,0,0,0,1|2,0,1]=4 1505 B11R1.20 CC(C)Nc1ccc(cc1)Cl 2230a_100000210052_100000210206 [0,0,0,0,0,1|2,0,1]=4 1506 B11R1.20 CC(C)Nc1ccc(cc1)Cl 34a_100000210052_100000210206 [0,0,0,0,0,1|2,0,1]=4 1507 B11R1.20 CC(C)Nc1ccc(cc1)F 34a_100000185862_100000210206 [0,0,0,0,0,1|2,0,1]=4 1508 B11R1.20 CC(C)Nc1ccc(cc1)I 34a_100000185761_100000210206 [0,0,0,0,0,1|2,0,1]=4 1509 B11R1.20 CC(C)Nc1ccc(cc1)O 271570a_203496583355_100000219625 [0,0,0,0,0,1|2,0,1]=4 1510 B11R1.20 CC(C)Nc1ccc(cc1)O 34a_100000185829_100000210206 [0,0,0,0,0,1|2,0,1]=4 1511 B11R1.20 CC(C)Oc1ccc(cc1)Br 34a_100000185759_100000210206 [0,0,0,0,0,1|2,0,1]=4 1512 B11R1.20 CC(C)Oc1ccc(cc1)Br 7a_100000185759_100000210206 [0,0,0,0,0,1|2,0,1]=4 1513 B11R1.20 CC(C)Oc1ccc(cc1)Cl 34a_100000210216_100000210206 [0,0,0,0,0,1|2,0,1]=4 1514 B11R1.20 CC(C)Oc1ccc(cc1)Cl 7a_100000210216_100000210206 [0,0,0,0,0,1|2,0,1]=4 1515 B11R1.20 CC(C)Oc1ccc(cc1)F 34a_100000210339_100000210206 [0,0,0,0,0,1|2,0,1]=4 1516 B11R1.20 CC(C)Oc1ccc(cc1)I 34a_100000212066_100000210206 [0,0,0,0,0,1|2,0,1]=4 1517 B11R1.20 CC(C)Oc1ccc(cc1)I 7a_100000212066_100000210206 [0,0,0,0,0,1|2,0,1]=4 1518 B11R1.20 CC(C)Oc1ccc(cc1)N 34a_100000185829_100000210206 [0,0,0,0,0,1|2,0,1]=4 1519 B11R1.20 CC(C)Oc1ccc(cc1)O 271570a_203496583355_100000169947 [0,0,0,0,0,1|2,0,1]=4 1520 B11R1.20 CC(C)Sc1ccc(cc1)Br 62a_100000210206_100000752885 [0,0,0,0,0,1|2,0,1]=4 1521 B11R1.20 CC(C)Sc1ccc(cc1)Br 62a_100000752885_100000210206 [0,0,0,0,0,1|2,0,1]=4 1522 B11R1.20 CC(C)Sc1ccc(cc1)Cl 62a_100000210206_100000755918 [0,0,0,0,0,1|2,0,1]=4 1523 B11R1.20 CC(C)Sc1ccc(cc1)Cl 62a_100000755918_100000210206 [0,0,0,0,0,1|2,0,1]=4 1524 B11R1.20 CC(C)Sc1ccc(cc1)F 62a_100000210206_100000211213 [0,0,0,0,0,1|2,0,1]=4 1525 B11R1.20 CC(C)Sc1ccc(cc1)F 62a_100000211213_100000210206 [0,0,0,0,0,1|2,0,1]=4 1526 B11R1.20 CC(C)Sc1ccc(cc1)N 62a_100000185761_100000210206 [0,0,0,0,0,1|2,0,1]=4 1527 B11R1.20 CC(C)Sc1ccc(cc1)N 62a_100000210206_100000185761 [0,0,0,0,0,1|2,0,1]=4 1528 B11R1.20 CC(C)Sc1ccc(cc1)O 271570a_203496583355_100009811894 [0,0,0,0,0,1|2,0,1]=4 1529 B11R1.20 CC(C)Sc1ccc(cc1)O 62a_100000210206_100000185759 [0,0,0,0,0,1|2,0,1]=4 1530 B11R1.20 CN(C)Cc1ccc(cc1)Br 2230a_100000180866_200000210301 [0,0,0,0,0,1|3,0,0]=4 1531 B11R1.20 CN(C)Cc1ccc(cc1)Br 2230a_100102631434_100011217064 [0,0,0,0,0,1|3,0,0]=4 1532 B11R1.20 CN(C)Cc1ccc(cc1)Br 269982a_100000180866_200000210301 [0,0,0,0,0,1|3,0,0]=4 1533 B11R1.20 CN(C)Cc1ccc(cc1)Br 269982a_100102631434_100011217064 [0,0,0,0,0,1|3,0,0]=4 1534 B11R1.20 CN(C)Cc1ccc(cc1)Br 270004a_100102631434_100000186029 [0,0,0,0,0,1|3,0,0]=4 1535 B11R1.20 CN(C)Cc1ccc(cc1)Cl 2230a_100000184517_200000210301 [0,0,0,0,0,1|3,0,0]=4 1536 B11R1.20 CN(C)Cc1ccc(cc1)Cl 2230a_100102631434_100000694040 [0,0,0,0,0,1|3,0,0]=4 1537 B11R1.20 CN(C)Cc1ccc(cc1)Cl 269982a_100000184517_200000210301 [0,0,0,0,0,1|3,0,0]=4 1538 B11R1.20 CN(C)Cc1ccc(cc1)Cl 269982a_100102631434_100000187161 [0,0,0,0,0,1|3,0,0]=4 1539 B11R1.20 CN(C)Cc1ccc(cc1)Cl 270004a_100102631434_100000189385 [0,0,0,0,0,1|3,0,0]=4 1540 B11R1.20 CN(C)Cc1ccc(cc1)Cl 34a_100000184517_200000210301 [0,0,0,0,0,1|3,0,0]=4 1541 B11R1.20 CN(C)Cc1ccc(cc1)F 2230a_100000184576_200000210301 [0,0,0,0,0,1|3,0,0]=4 1542 B11R1.20 CN(C)Cc1ccc(cc1)F 2230a_100102631434_100000198546 [0,0,0,0,0,1|3,0,0]=4 1543 B11R1.20 CN(C)Cc1ccc(cc1)F 269982a_100000184576_200000210301 [0,0,0,0,0,1|3,0,0]=4 1544 B11R1.20 CN(C)Cc1ccc(cc1)F 269982a_100102631434_100000198546 [0,0,0,0,0,1|3,0,0]=4 1545 B11R1.20 CN(C)Cc1ccc(cc1)F 270004a_100102631434_100000210084 [0,0,0,0,0,1|3,0,0]=4 1546 B11R1.20 CN(C)Cc1ccc(cc1)F 34a_100000184576_200000210301 [0,0,0,0,0,1|3,0,0]=4 1547 B11R1.20 CN(C)Cc1ccc(cc1)I 2230a_100102631434_100000189116 [0,0,0,0,0,1|3,0,0]=4 1548 B11R1.20 CN(C)Cc1ccc(cc1)I 269982a_100102631434_100000189116 [0,0,0,0,0,1|3,0,0]=4 1549 B11R1.20 CN(C)Cc1ccc(cc1)O 2230a_100000207500_200000210301 [0,0,0,0,0,1|3,0,0]=4 1550 B11R1.20 CN(C)Cc1ccc(cc1)O 269982a_100000207500_200000210301 [0,0,0,0,0,1|3,0,0]=4 1551 B11R1.20 CN(C)Cc1ccc(cc1)O 271570a_203496583355_100000174694 [0,0,0,0,0,1|3,0,0]=4 1552 B11R1.20 CN([13CH3])Cc1ccc(cc1)Br 2230a_100000180866_200025704644 [0,0,0,0,0,1|3,0,0]=4 1553 B11R1.20 CN([13CH3])Cc1ccc(cc1)Br 269982a_100000180866_200025704644 [0,0,0,0,0,1|3,0,0]=4 1554 B11R1.20 CN([13CH3])Cc1ccc(cc1)Cl 2230a_100000184517_200025704644 [0,0,0,0,0,1|3,0,0]=4 1555 B11R1.20 CN([13CH3])Cc1ccc(cc1)Cl 269982a_100000184517_200025704644 [0,0,0,0,0,1|3,0,0]=4 1556 B11R1.20 CN([13CH3])Cc1ccc(cc1)Cl 34a_100000184517_200025704644 [0,0,0,0,0,1|3,0,0]=4 1557 B11R1.20 CN([13CH3])Cc1ccc(cc1)F 2230a_100000184576_200025704644 [0,0,0,0,0,1|3,0,0]=4 1558 B11R1.20 CN([13CH3])Cc1ccc(cc1)F 269982a_100000184576_200025704644 [0,0,0,0,0,1|3,0,0]=4 1559 B11R1.20 CN([13CH3])Cc1ccc(cc1)F 34a_100000184576_200025704644 [0,0,0,0,0,1|3,0,0]=4 1560 B11R1.20 CN([13CH3])Cc1ccc(cc1)O 2230a_100000207500_200025704644 [0,0,0,0,0,1|3,0,0]=4 1561 B11R1.20 CN([13CH3])Cc1ccc(cc1)O 269982a_100000207500_200025704644 [0,0,0,0,0,1|3,0,0]=4 1562 B11R1.20 Cc1ccc(cc1)CC(=O)[13CH3] 1458a_100000212244_200025704644 [0,0,0,0,0,1|0,0,0]=1 1563 B11R1.20 Cc1ccc(cc1)CN(C)C 2230a_100000744650_200000210301 [0,0,0,0,0,1|2,0,0]=3 1564 B11R1.20 Cc1ccc(cc1)CN(C)C 2230a_100102631434_100000210814 [0,0,0,0,0,1|2,0,0]=3 1565 B11R1.20 Cc1ccc(cc1)CN(C)C 269982a_100000744650_200000210301 [0,0,0,0,0,1|2,0,0]=3 1566 B11R1.20 Cc1ccc(cc1)CN(C)C 269982a_100102631434_100000210814 [0,0,0,0,0,1|2,0,0]=3 1567 B11R1.20 Cc1ccc(cc1)CN(C)C 270004a_100102631434_100000211033 [0,0,0,0,0,1|2,0,0]=3 1568 B11R1.20 Cc1ccc(cc1)CN(C)C 34a_100000744650_200000210301 [0,0,0,0,0,1|2,0,0]=3 1569 B11R1.20 Cc1ccc(cc1)CN(C)[13CH3] 2230a_100000744650_200025704644 [0,0,0,0,0,1|2,0,0]=3 1570 B11R1.20 Cc1ccc(cc1)CN(C)[13CH3] 269982a_100000744650_200025704644 [0,0,0,0,0,1|2,0,0]=3 1571 B11R1.20 Cc1ccc(cc1)CN(C)[13CH3] 34a_100000744650_200025704644 [0,0,0,0,0,1|2,0,0]=3 1572 B11R1.20 Cc1ccc(cc1)NC(C)C 34a_100000124888_100000210206 [0,0,0,0,0,1|1,0,1]=3 1573 B11R1.20 Cc1ccc(cc1)OC(C)C 34a_100000210336_100000210206 [0,0,0,0,0,1|1,0,1]=3 1574 B11R1.20 Cc1ccc(cc1)OC(C)C 7a_100000210336_100000210206 [0,0,0,0,0,1|1,0,1]=3 1575 B11R1.20 Cc1ccc(cc1)SC(C)C 62a_100000186775_100000210206 [0,0,0,0,0,1|1,0,1]=3 1576 B11R1.20 Cc1ccc(cc1)SC(C)C 62a_100000210206_100000186775 [0,0,0,0,0,1|1,0,1]=3 1577 B11R1.20 Cc1ccc(cn1)CC(=O)[13CH3] 1458a_100000740413_200025704644 [0,0,0,0,0,1|1,0,0]=2 1578 B11R1.20 Cc1ccc(cn1)CN(C)C 2230a_100102631434_100016987292 [0,0,0,0,0,1|3,0,0]=4 1579 B11R1.20 Cc1ccc(cn1)CN(C)C 2230a_106623407658_200000210301 [0,0,0,0,0,1|3,0,0]=4 1580 B11R1.20 Cc1ccc(cn1)CN(C)C 269982a_100102631434_100016987292 [0,0,0,0,0,1|3,0,0]=4 1581 B11R1.20 Cc1ccc(cn1)CN(C)C 269982a_106623407658_200000210301 [0,0,0,0,0,1|3,0,0]=4 1582 B11R1.20 Cc1ccc(cn1)CN(C)C 270004a_100102631434_100000743784 [0,0,0,0,0,1|3,0,0]=4 1583 B11R1.20 Cc1ccc(cn1)CN(C)C 34a_106623407658_200000210301 [0,0,0,0,0,1|3,0,0]=4 1584 B11R1.20 Cc1ccc(cn1)CN(C)[13CH3] 2230a_106623407658_200025704644 [0,0,0,0,0,1|3,0,0]=4 1585 B11R1.20 Cc1ccc(cn1)CN(C)[13CH3] 269982a_106623407658_200025704644 [0,0,0,0,0,1|3,0,0]=4 1586 B11R1.20 Cc1ccc(cn1)CN(C)[13CH3] 34a_106623407658_200025704644 [0,0,0,0,0,1|3,0,0]=4 1587 B11R1.20 Cc1ccc(cn1)OC(C)C 34a_100000745506_100000210206 [0,0,0,0,0,1|2,0,1]=4 1588 B11R1.20 Cc1ccc(cn1)OC(C)C 7a_100000745506_100000210206 [0,0,0,0,0,1|2,0,1]=4 1589 B11R1.20 Cc1ccc(cn1)SC(C)C 62a_100000210206_100000751577 [0,0,0,0,0,1|2,0,1]=4 1590 B11R1.20 Cc1ccc(cn1)SC(C)C 62a_100000751577_100000210206 [0,0,0,0,0,1|2,0,1]=4 1591 B11R1.20 Cc1ccc(nc1)CC(=O)[13CH3] 1458a_100025705728_200025704644 [0,0,0,0,0,1|1,0,0]=2 1592 B11R1.20 Cc1ccc(nc1)CN(C)C 2230a_100102631434_100000691093 [0,0,0,0,0,1|3,0,0]=4 1593 B11R1.20 Cc1ccc(nc1)CN(C)C 2230a_200000717808_200000210301 [0,0,0,0,0,1|3,0,0]=4 1594 B11R1.20 Cc1ccc(nc1)CN(C)C 269982a_100102631434_100000691093 [0,0,0,0,0,1|3,0,0]=4 1595 B11R1.20 Cc1ccc(nc1)CN(C)C 269982a_200000717808_200000210301 [0,0,0,0,0,1|3,0,0]=4 1596 B11R1.20 Cc1ccc(nc1)CN(C)C 270004a_100102631434_100000050478 [0,0,0,0,0,1|3,0,0]=4 1597 B11R1.20 Cc1ccc(nc1)CN(C)[13CH3] 2230a_200000717808_200025704644 [0,0,0,0,0,1|3,0,0]=4 1598 B11R1.20 Cc1ccc(nc1)CN(C)[13CH3] 269982a_200000717808_200025704644 [0,0,0,0,0,1|3,0,0]=4 1599 B11R1.20 Cc1ccc(nc1)OC(C)C 34a_100000759353_100000210206 [0,0,0,0,0,1|2,0,1]=4 1600 B11R1.20 Cc1ccc(nc1)SC(C)C 62a_100000210206_100000754016 [0,0,0,0,0,1|2,0,1]=4 1601 B11R1.20 Cc1ccc(nc1)SC(C)C 62a_100011192072_100000210206 [0,0,0,0,0,1|2,0,1]=4 1602 B11R1.20 NC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000162331 [0,0,0,0,0,1|2,0,0]=3 1603 B11R1.20 NC(=O)Cc1ccc(cn1)O 271570a_203496583355_200010888337 [0,0,0,0,0,1|3,0,0]=4 1604 B11R1.20 NC(=O)Cc1ccc(nc1)O 271570a_203496583355_200000071513 [0,0,0,0,0,1|3,0,0]=4 1605 B11R1.20 NC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000198584 [0,0,0,0,0,1|2,0,0]=3 1606 B11R1.20 Oc1ccc(cc1)C=C(Br)Br 271570a_203496583355_200013992848 [0,0,0,0,0,1|3,0,0]=4 1607 B11R1.20 Oc1ccc(cc1)C=C(F)F 271570a_203496583355_200009816947 [0,0,0,0,0,1|3,0,0]=4 1608 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)Br 1458a_100000198978_200025704644 [0,0,0,0,0,1|1,0,0]=2 1609 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)Cl 1458a_100000211027_200025704644 [0,0,0,0,0,1|1,0,0]=2 1610 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)F 1458a_100000210951_200025704644 [0,0,0,0,0,1|1,0,0]=2 1611 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)I 1458a_100000688869_200025704644 [0,0,0,0,0,1|1,0,0]=2 1612 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)O 1458a_100000198540_200025704644 [0,0,0,0,0,1|1,0,0]=2 1613 B11R1.20 [13CH3]C(=O)Cc1ccc(cn1)Br 1458a_100020629044_200025704644 [0,0,0,0,0,1|2,0,0]=3 1614 B11R1.20 [13CH3]C(=O)Cc1ccc(cn1)Cl 1458a_100000728320_200025704644 [0,0,0,0,0,1|2,0,0]=3 1615 B11R1.20 [13CH3]C(=O)Cc1ccc(nc1)Br 1458a_100010067268_200025704644 [0,0,0,0,0,1|2,0,0]=3 1616 B11R1.20 [13CH3]C(=O)Cc1ccc(nc1)Cl 1458a_100000061944_200025704644 [0,0,0,0,0,1|2,0,0]=3 1617 B11R1.20 [13CH3]C(=O)Cn1ccc(=O)cc1 1458a_200000238563_200025704644 [0,0,0,0,0,1|2,0,0]=3 1618 B8R0.28 C=C(C)C=NNC(=O)C 4a_100000189765_100000210575 [1,0,1,0,0,0|2,0,0]=4 1619 B8R0.9 CC=C(C)C=CC(=O)C 1458a_100000692105_200000210301 [1,0,1,0,0,0|1,0,1]=4 1620 B8R0.9 CC=C(C)C=CC(=O)[13CH3] 1458a_100000692105_200025704644 [1,0,1,0,0,0|1,0,1]=4 1621 B8R1.2 C=Cc1ccccc1 271570a_100011290941_100000210277 [2,0,0,0,0,0|0,0,1]=3 1622 B8R1.2 C=Cc1ccccn1 271570a_100011290941_100011216584 [2,0,0,0,0,0|1,0,1]=4 1623 B8R1.2 C=Cc1cccnc1 271570a_100011290941_100000752921 [2,0,0,0,0,0|1,0,1]=4 1624 B8R1.2 C=Cc1ccncc1 271570a_100011290941_100000035832 [2,0,0,0,0,0|1,0,1]=4 1625 B8R1.2 CNc1ccccc1 34a_100000106764_200000210301 [2,0,0,0,0,0|1,0,0]=3 1626 B8R1.2 COc1ccccc1 34a_100000210340_200000210301 [2,0,0,0,0,0|1,0,0]=3 1627 B8R1.2 COc1ccccc1 7a_100000210340_200000210301 [2,0,0,0,0,0|1,0,0]=3 1628 B8R1.2 COc1cccnc1 34a_100000210849_200000210301 [2,0,0,0,0,0|2,0,0]=4 1629 B8R1.2 COc1cccnc1 7a_100000210849_200000210301 [2,0,0,0,0,0|2,0,0]=4 1630 B8R1.2 COc1ccncc1 34a_100000212176_200000210301 [2,0,0,0,0,0|2,0,0]=4 1631 B8R1.2 CSc1ccccc1 62a_100000719477_200000210301 [2,0,0,0,0,0|1,0,0]=3 1632 B8R1.2 CSc1ccccc1 62a_200000210301_100000041952 [2,0,0,0,0,0|1,0,0]=3 1633 B8R1.2 CSc1ccccn1 62a_100011216584_200000210301 [2,0,0,0,0,0|2,0,0]=4 1634 B8R1.2 CSc1ccccn1 62a_200000210301_100011216584 [2,0,0,0,0,0|2,0,0]=4 1635 B8R1.2 CSc1cccnc1 62a_100000210063_200000210301 [2,0,0,0,0,0|2,0,0]=4 1636 B8R1.2 CSc1cccnc1 62a_200000210301_100000210063 [2,0,0,0,0,0|2,0,0]=4 1637 B8R1.2 CSc1ccncc1 62a_100000728582_200000210301 [2,0,0,0,0,0|2,0,0]=4 1638 B8R1.2 CSc1ccncc1 62a_200000210301_100000728582 [2,0,0,0,0,0|2,0,0]=4 1639 B8R1.2 [13CH3]Nc1ccccc1 34a_100000106764_200025704644 [2,0,0,0,0,0|1,0,0]=3 1640 B8R1.2 [13CH3]Oc1ccccc1 34a_100000210340_200025704644 [2,0,0,0,0,0|1,0,0]=3 1641 B8R1.2 [13CH3]Oc1ccccc1 7a_100000210340_200025704644 [2,0,0,0,0,0|1,0,0]=3 1642 B8R1.2 [13CH3]Oc1cccnc1 34a_100000210849_200025704644 [2,0,0,0,0,0|2,0,0]=4 1643 B8R1.2 [13CH3]Oc1cccnc1 7a_100000210849_200025704644 [2,0,0,0,0,0|2,0,0]=4 1644 B8R1.2 [13CH3]Oc1ccncc1 34a_100000212176_200025704644 [2,0,0,0,0,0|2,0,0]=4 1645 B8R1.2 [13CH3]Sc1ccccc1 62a_100000719477_200025704644 [2,0,0,0,0,0|1,0,0]=3 1646 B8R1.2 [13CH3]Sc1ccccc1 62a_200025704644_100000041952 [2,0,0,0,0,0|1,0,0]=3 1647 B8R1.2 [13CH3]Sc1ccccn1 62a_100011216584_200025704644 [2,0,0,0,0,0|2,0,0]=4 1648 B8R1.2 [13CH3]Sc1ccccn1 62a_200025704644_100011216584 [2,0,0,0,0,0|2,0,0]=4 1649 B8R1.2 [13CH3]Sc1cccnc1 62a_100000210063_200025704644 [2,0,0,0,0,0|2,0,0]=4 1650 B8R1.2 [13CH3]Sc1cccnc1 62a_200025704644_100000210063 [2,0,0,0,0,0|2,0,0]=4 1651 B8R1.2 [13CH3]Sc1ccncc1 62a_100000728582_200025704644 [2,0,0,0,0,0|2,0,0]=4 1652 B8R1.2 [13CH3]Sc1ccncc1 62a_200025704644_100000728582 [2,0,0,0,0,0|2,0,0]=4 1653 B8R1.3 Cc1ccc(cc1)O 271570a_203496583355_100000186775 [2,0,0,0,0,0|0,0,1]=3 1654 B8R1.3 Cc1ccc(cn1)O 271570a_203496583355_100000751577 [2,0,0,0,0,0|1,0,1]=4 1655 B8R1.3 Cc1ccc(nc1)O 271570a_203496583355_100000754016 [2,0,0,0,0,0|1,0,1]=4 1656 B8R1.3 Nc1ccc(cc1)O 271570a_203496583355_100000185761 [2,0,0,0,0,0|1,0,1]=4 1657 B8R1.3 O=c1ccc(c[nH]1)O 271570a_203496583355_100000212171 [2,0,0,0,0,0|2,0,0]=4 1658 B8R1.3 Oc1ccc(cc1)Br 271570a_203496583355_100000752885 [2,0,0,0,0,0|1,0,1]=4 1659 B8R1.3 Oc1ccc(cc1)Cl 271570a_203496583355_100000755918 [2,0,0,0,0,0|1,0,1]=4 1660 B8R1.3 Oc1ccc(cc1)F 271570a_203496583355_100000211213 [2,0,0,0,0,0|1,0,1]=4 1661 B8R1.3 Oc1ccc(cc1)O 271570a_203496583355_100000185759 [2,0,0,0,0,0|1,0,1]=4 1662 B10R0.93 C=C(C)C(=O)CC(=O)C(=O)C 1458a_100000185857_100011261029 [0,1,1,0,0,0|1,0,1]=4 1663 B10R1.1 C/C=C/c1ccc(cc1)O 271570a_203496583355_100016259036 [1,1,0,0,0,0|1,0,0]=3 1664 B10R1.1 C=C=Cc1ccc(cc1)Br 271570a_100015277604_100000752885 [1,1,0,0,0,0|1,0,1]=4 1665 B10R1.1 C=C=Cc1ccc(cc1)C 271570a_100015277604_100000186775 [1,1,0,0,0,0|0,0,1]=3 1666 B10R1.1 C=C=Cc1ccc(cc1)Cl 271570a_100015277604_100000755918 [1,1,0,0,0,0|1,0,1]=4 1667 B10R1.1 C=C=Cc1ccc(cc1)F 271570a_100015277604_100000211213 [1,1,0,0,0,0|1,0,1]=4 1668 B10R1.1 C=C=Cc1ccc(cc1)N 271570a_100015277604_100000185761 [1,1,0,0,0,0|1,0,1]=4 1669 B10R1.1 C=C=Cc1ccc(cc1)O 271570a_100015277604_100000185759 [1,1,0,0,0,0|1,0,1]=4 1670 B10R1.1 C=C=Cc1ccc(cn1)C 271570a_100015277604_100000754016 [1,1,0,0,0,0|1,0,1]=4 1671 B10R1.1 C=C=Cc1ccc(nc1)C 271570a_100015277604_100000751577 [1,1,0,0,0,0|1,0,1]=4 1672 B10R1.1 CC=Cc1cc[n+](cc1)[O-] 271570a_100016259895_100000039755 [1,1,0,0,0,0|2,0,0]=4 1673 B10R1.1 CC=Cc1ccc(=O)[nH]c1 271570a_100016259895_100000212171 [1,1,0,0,0,0|2,0,0]=4 1674 B10R1.1 CC=Cc1ccc(cc1)Br 271570a_100016259895_100000752885 [1,1,0,0,0,0|1,0,0]=3 1675 B10R1.1 CC=Cc1ccc(cc1)C 271570a_100016259895_100000186775 [1,1,0,0,0,0|0,0,0]=2 1676 B10R1.1 CC=Cc1ccc(cc1)Cl 271570a_100016259895_100000755918 [1,1,0,0,0,0|1,0,0]=3 1677 B10R1.1 CC=Cc1ccc(cc1)F 271570a_100016259895_100000211213 [1,1,0,0,0,0|1,0,0]=3 1678 B10R1.1 CC=Cc1ccc(cc1)N 271570a_100016259895_100000185761 [1,1,0,0,0,0|1,0,0]=3 1679 B10R1.1 CC=Cc1ccc(cc1)O 271570a_100016259895_100000185759 [1,1,0,0,0,0|1,0,0]=3 1680 B10R1.1 CC=Cc1ccc(cn1)Br 271570a_100016259895_100000686858 [1,1,0,0,0,0|2,0,0]=4 1681 B10R1.1 CC=Cc1ccc(cn1)C 271570a_100016259895_100000754016 [1,1,0,0,0,0|1,0,0]=3 1682 B10R1.1 CC=Cc1ccc(cn1)Cl 271570a_100016259895_100011356976 [1,1,0,0,0,0|2,0,0]=4 1683 B10R1.1 CC=Cc1ccc(cn1)F 271570a_100016259895_100000744514 [1,1,0,0,0,0|2,0,0]=4 1684 B10R1.1 CC=Cc1ccc(cn1)N 271570a_100016259895_100000744251 [1,1,0,0,0,0|2,0,0]=4 1685 B10R1.1 CC=Cc1ccc(cn1)O 271570a_100016259895_100000685995 [1,1,0,0,0,0|2,0,0]=4 1686 B10R1.1 CC=Cc1ccc(nc1)Br 271570a_100016259895_100009814638 [1,1,0,0,0,0|2,0,0]=4 1687 B10R1.1 CC=Cc1ccc(nc1)C 271570a_100016259895_100000751577 [1,1,0,0,0,0|1,0,0]=3 1688 B10R1.1 CC=Cc1ccc(nc1)Cl 271570a_100016259895_100000034144 [1,1,0,0,0,0|2,0,0]=4 1689 B10R1.1 CC=Cc1ccc(nc1)F 271570a_100016259895_100000748661 [1,1,0,0,0,0|2,0,0]=4 1690 B10R1.1 CC=Cc1ccc(nc1)N 271570a_100016259895_100000187370 [1,1,0,0,0,0|2,0,0]=4 1691 B10R1.1 CC=Cc1ccc(nn1)C 271570a_100016259895_100011450037 [1,1,0,0,0,0|2,0,0]=4 1692 B10R1.1 CC=Cc1cnc(cn1)C 271570a_100016259895_100011999403 [1,1,0,0,0,0|2,0,0]=4 1693 B10R1.1 CC=Cc1cnc(nc1)C 271570a_100016259895_100000686985 [1,1,0,0,0,0|2,0,0]=4 1694 B10R1.1 CC=Cc1ncc(cn1)C 271570a_100016259895_100011825175 [1,1,0,0,0,0|2,0,0]=4 1695 B10R1.1 CCCc1ccc(cc1)O 271570a_203496583355_100000750032 [1,1,0,0,0,0|1,0,1]=4 1696 B10R1.1 CCNc1ccc(cc1)Br 2230a_100000210018_100000210202 [1,1,0,0,0,0|1,0,1]=4 1697 B10R1.1 CCNc1ccc(cc1)Br 34a_100000210018_100000210202 [1,1,0,0,0,0|1,0,1]=4 1698 B10R1.1 CCNc1ccc(cc1)C 34a_100000124888_100000210202 [1,1,0,0,0,0|0,0,1]=3 1699 B10R1.1 CCNc1ccc(cc1)Cl 2230a_100000210052_100000210202 [1,1,0,0,0,0|1,0,1]=4 1700 B10R1.1 CCNc1ccc(cc1)Cl 34a_100000210052_100000210202 [1,1,0,0,0,0|1,0,1]=4 1701 B10R1.1 CCNc1ccc(cc1)F 34a_100000185862_100000210202 [1,1,0,0,0,0|1,0,1]=4 1702 B10R1.1 CCNc1ccc(cc1)I 34a_100000185761_100000210202 [1,1,0,0,0,0|1,0,1]=4 1703 B10R1.1 CCNc1ccc(cc1)O 271570a_203496583355_100000219632 [1,1,0,0,0,0|1,0,1]=4 1704 B10R1.1 CCNc1ccc(cc1)O 34a_100000185829_100000210202 [1,1,0,0,0,0|1,0,1]=4 1705 B10R1.1 CCOc1ccc(cc1)Br 34a_100000185759_100000210202 [1,1,0,0,0,0|1,0,1]=4 1706 B10R1.1 CCOc1ccc(cc1)Br 7a_100000185759_100000210202 [1,1,0,0,0,0|1,0,1]=4 1707 B10R1.1 CCOc1ccc(cc1)C 34a_100000210336_100000210202 [1,1,0,0,0,0|0,0,1]=3 1708 B10R1.1 CCOc1ccc(cc1)C 7a_100000210336_100000210202 [1,1,0,0,0,0|0,0,1]=3 1709 B10R1.1 CCOc1ccc(cc1)Cl 34a_100000210216_100000210202 [1,1,0,0,0,0|1,0,1]=4 1710 B10R1.1 CCOc1ccc(cc1)Cl 7a_100000210216_100000210202 [1,1,0,0,0,0|1,0,1]=4 1711 B10R1.1 CCOc1ccc(cc1)F 34a_100000210339_100000210202 [1,1,0,0,0,0|1,0,1]=4 1712 B10R1.1 CCOc1ccc(cc1)I 34a_100000212066_100000210202 [1,1,0,0,0,0|1,0,1]=4 1713 B10R1.1 CCOc1ccc(cc1)I 7a_100000212066_100000210202 [1,1,0,0,0,0|1,0,1]=4 1714 B10R1.1 CCOc1ccc(cc1)N 34a_100000185829_100000210202 [1,1,0,0,0,0|1,0,1]=4 1715 B10R1.1 CCOc1ccc(cc1)O 271570a_203496583355_100000169946 [1,1,0,0,0,0|1,0,1]=4 1716 B10R1.1 CCOc1ccc(cn1)C 34a_100000759353_100000210202 [1,1,0,0,0,0|1,0,1]=4 1717 B10R1.1 CCOc1ccc(nc1)C 34a_100000745506_100000210202 [1,1,0,0,0,0|1,0,1]=4 1718 B10R1.1 CCOc1ccc(nc1)C 7a_100000745506_100000210202 [1,1,0,0,0,0|1,0,1]=4 1719 B10R1.1 CCSc1ccc(cc1)Br 62a_100000210202_100000752885 [1,1,0,0,0,0|1,0,1]=4 1720 B10R1.1 CCSc1ccc(cc1)Br 62a_100000752885_100000210202 [1,1,0,0,0,0|1,0,1]=4 1721 B10R1.1 CCSc1ccc(cc1)C 62a_100000186775_100000210202 [1,1,0,0,0,0|0,0,1]=3 1722 B10R1.1 CCSc1ccc(cc1)C 62a_100000210202_100000186775 [1,1,0,0,0,0|0,0,1]=3 1723 B10R1.1 CCSc1ccc(cc1)Cl 62a_100000210202_100000755918 [1,1,0,0,0,0|1,0,1]=4 1724 B10R1.1 CCSc1ccc(cc1)Cl 62a_100000755918_100000210202 [1,1,0,0,0,0|1,0,1]=4 1725 B10R1.1 CCSc1ccc(cc1)F 62a_100000210202_100000211213 [1,1,0,0,0,0|1,0,1]=4 1726 B10R1.1 CCSc1ccc(cc1)F 62a_100000211213_100000210202 [1,1,0,0,0,0|1,0,1]=4 1727 B10R1.1 CCSc1ccc(cc1)N 62a_100000185761_100000210202 [1,1,0,0,0,0|1,0,1]=4 1728 B10R1.1 CCSc1ccc(cc1)N 62a_100000210202_100000185761 [1,1,0,0,0,0|1,0,1]=4 1729 B10R1.1 CCSc1ccc(cc1)O 271570a_203496583355_200009811893 [1,1,0,0,0,0|1,0,1]=4 1730 B10R1.1 CCSc1ccc(cc1)O 62a_100000210202_100000185759 [1,1,0,0,0,0|1,0,1]=4 1731 B10R1.1 CCSc1ccc(cn1)C 62a_100000210202_100000754016 [1,1,0,0,0,0|1,0,1]=4 1732 B10R1.1 CCSc1ccc(cn1)C 62a_100011192072_100000210202 [1,1,0,0,0,0|1,0,1]=4 1733 B10R1.1 CCSc1ccc(nc1)C 62a_100000210202_100000751577 [1,1,0,0,0,0|1,0,1]=4 1734 B10R1.1 CCSc1ccc(nc1)C 62a_100000751577_100000210202 [1,1,0,0,0,0|1,0,1]=4 1735 B10R1.1 CNCc1ccc(cc1)Br 207a_100102657272_100000186029 [1,1,0,0,0,0|1,0,1]=4 1736 B10R1.1 CNCc1ccc(cc1)Br 2230a_100000174875_200000210301 [1,1,0,0,0,0|1,0,1]=4 1737 B10R1.1 CNCc1ccc(cc1)Br 2230a_106832991635_100011217064 [1,1,0,0,0,0|1,0,1]=4 1738 B10R1.1 CNCc1ccc(cc1)Br 26a_100102657272_100000185759 [1,1,0,0,0,0|1,0,1]=4 1739 B10R1.1 CNCc1ccc(cc1)Br 270004a_106832991635_100000186029 [1,1,0,0,0,0|1,0,1]=4 1740 B10R1.1 CNCc1ccc(cc1)Br 34a_100000174875_200000210301 [1,1,0,0,0,0|1,0,1]=4 1741 B10R1.1 CNCc1ccc(cc1)Br 34a_100102657272_100000189115 [1,1,0,0,0,0|1,0,1]=4 1742 B10R1.1 CNCc1ccc(cc1)Br 7a_106832991635_100011217064 [1,1,0,0,0,0|1,0,1]=4 1743 B10R1.1 CNCc1ccc(cc1)C 207a_100102657272_100000211033 [1,1,0,0,0,0|0,0,1]=3 1744 B10R1.1 CNCc1ccc(cc1)C 2230a_100000174908_200000210301 [1,1,0,0,0,0|0,0,1]=3 1745 B10R1.1 CNCc1ccc(cc1)C 2230a_106832991635_100000210814 [1,1,0,0,0,0|0,0,1]=3 1746 B10R1.1 CNCc1ccc(cc1)C 26a_100102657272_200020625495 [1,1,0,0,0,0|0,0,1]=3 1747 B10R1.1 CNCc1ccc(cc1)C 270004a_106832991635_100000211033 [1,1,0,0,0,0|0,0,1]=3 1748 B10R1.1 CNCc1ccc(cc1)C 34a_100000174908_200000210301 [1,1,0,0,0,0|0,0,1]=3 1749 B10R1.1 CNCc1ccc(cc1)C 34a_100102657272_100000210814 [1,1,0,0,0,0|0,0,1]=3 1750 B10R1.1 CNCc1ccc(cc1)C 7a_106832991635_100000210814 [1,1,0,0,0,0|0,0,1]=3 1751 B10R1.1 CNCc1ccc(cc1)Cl 207a_100102657272_100000189385 [1,1,0,0,0,0|1,0,1]=4 1752 B10R1.1 CNCc1ccc(cc1)Cl 2230a_100000174871_200000210301 [1,1,0,0,0,0|1,0,1]=4 1753 B10R1.1 CNCc1ccc(cc1)Cl 2230a_106832991635_100000694040 [1,1,0,0,0,0|1,0,1]=4 1754 B10R1.1 CNCc1ccc(cc1)Cl 270004a_106832991635_100000189385 [1,1,0,0,0,0|1,0,1]=4 1755 B10R1.1 CNCc1ccc(cc1)Cl 34a_100000174871_200000210301 [1,1,0,0,0,0|1,0,1]=4 1756 B10R1.1 CNCc1ccc(cc1)Cl 34a_100102657272_100000694040 [1,1,0,0,0,0|1,0,1]=4 1757 B10R1.1 CNCc1ccc(cc1)Cl 7a_106832991635_100000187161 [1,1,0,0,0,0|1,0,1]=4 1758 B10R1.1 CNCc1ccc(cc1)F 207a_100102657272_100000210084 [1,1,0,0,0,0|1,0,1]=4 1759 B10R1.1 CNCc1ccc(cc1)F 2230a_100000174882_200000210301 [1,1,0,0,0,0|1,0,1]=4 1760 B10R1.1 CNCc1ccc(cc1)F 2230a_106832991635_100000198546 [1,1,0,0,0,0|1,0,1]=4 1761 B10R1.1 CNCc1ccc(cc1)F 270004a_106832991635_100000210084 [1,1,0,0,0,0|1,0,1]=4 1762 B10R1.1 CNCc1ccc(cc1)F 34a_100000174882_200000210301 [1,1,0,0,0,0|1,0,1]=4 1763 B10R1.1 CNCc1ccc(cc1)F 34a_100102657272_100000198546 [1,1,0,0,0,0|1,0,1]=4 1764 B10R1.1 CNCc1ccc(cc1)F 7a_106832991635_100000198546 [1,1,0,0,0,0|1,0,1]=4 1765 B10R1.1 CNCc1ccc(cc1)I 207a_100102657272_100000188517 [1,1,0,0,0,0|1,0,1]=4 1766 B10R1.1 CNCc1ccc(cc1)I 2230a_100016989417_200000210301 [1,1,0,0,0,0|1,0,1]=4 1767 B10R1.1 CNCc1ccc(cc1)I 2230a_106832991635_100000189116 [1,1,0,0,0,0|1,0,1]=4 1768 B10R1.1 CNCc1ccc(cc1)I 34a_100016989417_200000210301 [1,1,0,0,0,0|1,0,1]=4 1769 B10R1.1 CNCc1ccc(cc1)I 34a_100102657272_100000189116 [1,1,0,0,0,0|1,0,1]=4 1770 B10R1.1 CNCc1ccc(cc1)I 7a_106832991635_100000189116 [1,1,0,0,0,0|1,0,1]=4 1771 B10R1.1 CNCc1ccc(cc1)O 271570a_203496583355_100000180866 [1,1,0,0,0,0|1,0,1]=4 1772 B10R1.1 CNCc1ccc(cc1)O 34a_100000185549_200000210301 [1,1,0,0,0,0|1,0,1]=4 1773 B10R1.1 CNCc1ccc(cn1)C 207a_100102657272_100000050478 [1,1,0,0,0,0|1,0,1]=4 1774 B10R1.1 CNCc1ccc(cn1)C 2230a_106832991635_100000691093 [1,1,0,0,0,0|1,0,1]=4 1775 B10R1.1 CNCc1ccc(cn1)C 270004a_106832991635_100000050478 [1,1,0,0,0,0|1,0,1]=4 1776 B10R1.1 CNCc1ccc(cn1)C 34a_100015187455_200000210301 [1,1,0,0,0,0|1,0,1]=4 1777 B10R1.1 CNCc1ccc(cn1)C 34a_100102657272_100000691093 [1,1,0,0,0,0|1,0,1]=4 1778 B10R1.1 CNCc1ccc(cn1)C 7a_106832991635_100000691093 [1,1,0,0,0,0|1,0,1]=4 1779 B10R1.1 CNCc1ccc(nc1)C 2230a_106832991635_100016987292 [1,1,0,0,0,0|1,0,1]=4 1780 B10R1.1 CNCc1ccc(nc1)C 270004a_106832991635_100000743784 [1,1,0,0,0,0|1,0,1]=4 1781 B10R1.1 CNCc1ccc(nc1)C 34a_100000740942_200000210301 [1,1,0,0,0,0|1,0,1]=4 1782 B10R1.1 CNCc1ccc(nc1)C 34a_100102657272_100016987292 [1,1,0,0,0,0|1,0,1]=4 1783 B10R1.1 CNCc1ccc(nc1)C 7a_106832991635_100016987292 [1,1,0,0,0,0|1,0,1]=4 1784 B10R1.1 COCc1cc[n+](cc1)C 34a_100009831711_200000210301 [1,1,0,0,0,0|1,0,1]=4 1785 B10R1.1 COCc1ccc(cc1)Br 34a_100000695286_200000210301 [1,1,0,0,0,0|1,0,1]=4 1786 B10R1.1 COCc1ccc(cc1)Br 34a_100138415774_100000189115 [1,1,0,0,0,0|1,0,1]=4 1787 B10R1.1 COCc1ccc(cc1)C 34a_100011215236_200000210301 [1,1,0,0,0,0|0,0,1]=3 1788 B10R1.1 COCc1ccc(cc1)C 34a_100138415774_100000210814 [1,1,0,0,0,0|0,0,1]=3 1789 B10R1.1 COCc1ccc(cc1)C 7a_100011215236_200000210301 [1,1,0,0,0,0|0,0,1]=3 1790 B10R1.1 COCc1ccc(cc1)Cl 34a_100000211118_200000210301 [1,1,0,0,0,0|1,0,1]=4 1791 B10R1.1 COCc1ccc(cc1)Cl 34a_100138415774_100000694040 [1,1,0,0,0,0|1,0,1]=4 1792 B10R1.1 COCc1ccc(cc1)Cl 7a_100000211118_200000210301 [1,1,0,0,0,0|1,0,1]=4 1793 B10R1.1 COCc1ccc(cc1)F 34a_100000210977_200000210301 [1,1,0,0,0,0|1,0,1]=4 1794 B10R1.1 COCc1ccc(cc1)F 34a_100138415774_100000198546 [1,1,0,0,0,0|1,0,1]=4 1795 B10R1.1 COCc1ccc(cc1)F 7a_100000210977_200000210301 [1,1,0,0,0,0|1,0,1]=4 1796 B10R1.1 COCc1ccc(cc1)I 34a_100000690907_200000210301 [1,1,0,0,0,0|1,0,1]=4 1797 B10R1.1 COCc1ccc(cc1)I 34a_100138415774_100000189116 [1,1,0,0,0,0|1,0,1]=4 1798 B10R1.1 COCc1ccc(cc1)I 7a_100000690907_200000210301 [1,1,0,0,0,0|1,0,1]=4 1799 B10R1.1 COCc1ccc(cc1)N 34a_100011215238_200000210301 [1,1,0,0,0,0|1,0,1]=4 1800 B10R1.1 COCc1ccc(cc1)O 271570a_203496583355_100011493685 [1,1,0,0,0,0|1,0,1]=4 1801 B10R1.1 COCc1ccc(cn1)C 34a_100012001401_200000210301 [1,1,0,0,0,0|1,0,1]=4 1802 B10R1.1 COCc1ccc(cn1)C 34a_100138415774_100000691093 [1,1,0,0,0,0|1,0,1]=4 1803 B10R1.1 COCc1ccc(nc1)C 34a_100011248133_200000210301 [1,1,0,0,0,0|1,0,1]=4 1804 B10R1.1 COCc1ccc(nc1)C 34a_100138415774_100016987292 [1,1,0,0,0,0|1,0,1]=4 1805 B10R1.1 CSCc1ccc(cc1)Br 62a_100000189115_200000210301 [1,1,0,0,0,0|1,0,1]=4 1806 B10R1.1 CSCc1ccc(cc1)Br 62a_200000210301_100000189115 [1,1,0,0,0,0|1,0,1]=4 1807 B10R1.1 CSCc1ccc(cc1)C 62a_100000210814_200000210301 [1,1,0,0,0,0|0,0,1]=3 1808 B10R1.1 CSCc1ccc(cc1)C 62a_200000210301_100000210814 [1,1,0,0,0,0|0,0,1]=3 1809 B10R1.1 CSCc1ccc(cc1)Cl 62a_100000187161_200000210301 [1,1,0,0,0,0|1,0,1]=4 1810 B10R1.1 CSCc1ccc(cc1)Cl 62a_200000210301_100000187161 [1,1,0,0,0,0|1,0,1]=4 1811 B10R1.1 CSCc1ccc(cc1)F 62a_100000198546_200000210301 [1,1,0,0,0,0|1,0,1]=4 1812 B10R1.1 CSCc1ccc(cc1)F 62a_200000210301_100000187164 [1,1,0,0,0,0|1,0,1]=4 1813 B10R1.1 CSCc1ccc(cc1)I 62a_100000189116_200000210301 [1,1,0,0,0,0|1,0,1]=4 1814 B10R1.1 CSCc1ccc(cc1)I 62a_200000210301_100000189116 [1,1,0,0,0,0|1,0,1]=4 1815 B10R1.1 CSCc1ccc(cn1)C 62a_100000691093_200000210301 [1,1,0,0,0,0|1,0,1]=4 1816 B10R1.1 CSCc1ccc(cn1)C 62a_200000210301_100000691093 [1,1,0,0,0,0|1,0,1]=4 1817 B10R1.1 CSCc1ccc(nc1)C 62a_100016987292_200000210301 [1,1,0,0,0,0|1,0,1]=4 1818 B10R1.1 CSCc1ccc(nc1)C 62a_200000210301_100016987292 [1,1,0,0,0,0|1,0,1]=4 1819 B10R1.1 C[n+]1ccc(cc1)CO[13CH3] 34a_100009831711_200025704644 [1,1,0,0,0,0|1,0,1]=4 1820 B10R1.1 Cc1ccc(cc1)CN[13CH3] 2230a_100000174908_200025704644 [1,1,0,0,0,0|0,0,1]=3 1821 B10R1.1 Cc1ccc(cc1)CN[13CH3] 34a_100000174908_200025704644 [1,1,0,0,0,0|0,0,1]=3 1822 B10R1.1 Cc1ccc(cc1)CO[13CH3] 34a_100011215236_200025704644 [1,1,0,0,0,0|0,0,1]=3 1823 B10R1.1 Cc1ccc(cc1)CO[13CH3] 7a_100011215236_200025704644 [1,1,0,0,0,0|0,0,1]=3 1824 B10R1.1 Cc1ccc(cc1)CS[13CH3] 62a_100000210814_200025704644 [1,1,0,0,0,0|0,0,1]=3 1825 B10R1.1 Cc1ccc(cc1)CS[13CH3] 62a_200025704644_100000210814 [1,1,0,0,0,0|0,0,1]=3 1826 B10R1.1 Cc1ccc(cc1)NCF 34a_100000124888_100015361967 [1,1,0,0,0,0|1,0,0]=3 1827 B10R1.1 Cc1ccc(cc1)OCF 34a_100000210336_100015361967 [1,1,0,0,0,0|1,0,0]=3 1828 B10R1.1 Cc1ccc(cc1)OCF 7a_100000210336_100015361967 [1,1,0,0,0,0|1,0,0]=3 1829 B10R1.1 Cc1ccc(cc1)SCF 62a_100000186775_100015361967 [1,1,0,0,0,0|1,0,0]=3 1830 B10R1.1 Cc1ccc(cc1)SCF 62a_100015361967_100000186775 [1,1,0,0,0,0|1,0,0]=3 1831 B10R1.1 Cc1ccc(cn1)CN[13CH3] 34a_100000740942_200025704644 [1,1,0,0,0,0|1,0,1]=4 1832 B10R1.1 Cc1ccc(cn1)CO[13CH3] 34a_100011248133_200025704644 [1,1,0,0,0,0|1,0,1]=4 1833 B10R1.1 Cc1ccc(cn1)CS[13CH3] 62a_100016987292_200025704644 [1,1,0,0,0,0|1,0,1]=4 1834 B10R1.1 Cc1ccc(cn1)CS[13CH3] 62a_200025704644_100016987292 [1,1,0,0,0,0|1,0,1]=4 1835 B10R1.1 Cc1ccc(cn1)OCF 34a_100000745506_100015361967 [1,1,0,0,0,0|2,0,0]=4 1836 B10R1.1 Cc1ccc(cn1)OCF 7a_100000745506_100015361967 [1,1,0,0,0,0|2,0,0]=4 1837 B10R1.1 Cc1ccc(cn1)SCF 62a_100000751577_100015361967 [1,1,0,0,0,0|2,0,0]=4 1838 B10R1.1 Cc1ccc(cn1)SCF 62a_100015361967_100000751577 [1,1,0,0,0,0|2,0,0]=4 1839 B10R1.1 Cc1ccc(nc1)CN[13CH3] 34a_100015187455_200025704644 [1,1,0,0,0,0|1,0,1]=4 1840 B10R1.1 Cc1ccc(nc1)CO[13CH3] 34a_100012001401_200025704644 [1,1,0,0,0,0|1,0,1]=4 1841 B10R1.1 Cc1ccc(nc1)CS[13CH3] 62a_100000691093_200025704644 [1,1,0,0,0,0|1,0,1]=4 1842 B10R1.1 Cc1ccc(nc1)CS[13CH3] 62a_200025704644_100000691093 [1,1,0,0,0,0|1,0,1]=4 1843 B10R1.1 Cc1ccc(nc1)OCF 34a_100000759353_100015361967 [1,1,0,0,0,0|2,0,0]=4 1844 B10R1.1 Cc1ccc(nc1)SCF 62a_100011192072_100015361967 [1,1,0,0,0,0|2,0,0]=4 1845 B10R1.1 Cc1ccc(nc1)SCF 62a_100015361967_100000754016 [1,1,0,0,0,0|2,0,0]=4 1846 B10R1.1 FCNc1ccc(cc1)Br 34a_100000210018_100015361967 [1,1,0,0,0,0|2,0,0]=4 1847 B10R1.1 FCNc1ccc(cc1)Cl 34a_100000210052_100015361967 [1,1,0,0,0,0|2,0,0]=4 1848 B10R1.1 FCNc1ccc(cc1)F 34a_100000185862_100015361967 [1,1,0,0,0,0|2,0,0]=4 1849 B10R1.1 FCNc1ccc(cc1)I 34a_100000185761_100015361967 [1,1,0,0,0,0|2,0,0]=4 1850 B10R1.1 FCOc1ccc(cc1)Br 34a_100000185759_100015361967 [1,1,0,0,0,0|2,0,0]=4 1851 B10R1.1 FCOc1ccc(cc1)Br 7a_100000185759_100015361967 [1,1,0,0,0,0|2,0,0]=4 1852 B10R1.1 FCOc1ccc(cc1)Cl 34a_100000210216_100015361967 [1,1,0,0,0,0|2,0,0]=4 1853 B10R1.1 FCOc1ccc(cc1)Cl 7a_100000210216_100015361967 [1,1,0,0,0,0|2,0,0]=4 1854 B10R1.1 FCOc1ccc(cc1)F 34a_100000210339_100015361967 [1,1,0,0,0,0|2,0,0]=4 1855 B10R1.1 FCOc1ccc(cc1)I 34a_100000212066_100015361967 [1,1,0,0,0,0|2,0,0]=4 1856 B10R1.1 FCOc1ccc(cc1)I 7a_100000212066_100015361967 [1,1,0,0,0,0|2,0,0]=4 1857 B10R1.1 FCSc1ccc(cc1)Br 62a_100000752885_100015361967 [1,1,0,0,0,0|2,0,0]=4 1858 B10R1.1 FCSc1ccc(cc1)Br 62a_100015361967_100000752885 [1,1,0,0,0,0|2,0,0]=4 1859 B10R1.1 FCSc1ccc(cc1)Cl 62a_100000755918_100015361967 [1,1,0,0,0,0|2,0,0]=4 1860 B10R1.1 FCSc1ccc(cc1)Cl 62a_100015361967_100000755918 [1,1,0,0,0,0|2,0,0]=4 1861 B10R1.1 FCSc1ccc(cc1)F 62a_100000211213_100015361967 [1,1,0,0,0,0|2,0,0]=4 1862 B10R1.1 FCSc1ccc(cc1)F 62a_100015361967_100000211213 [1,1,0,0,0,0|2,0,0]=4 1863 B10R1.1 NCCc1ccc(cc1)O 271570a_203496583355_100000755846 [1,1,0,0,0,0|1,0,1]=4 1864 B10R1.1 Nc1ccc(cc1)OCF 34a_100000185829_100015361967 [1,1,0,0,0,0|2,0,0]=4 1865 B10R1.1 Nc1ccc(cc1)SCF 62a_100000185761_100015361967 [1,1,0,0,0,0|2,0,0]=4 1866 B10R1.1 Nc1ccc(cc1)SCF 62a_100015361967_100000185761 [1,1,0,0,0,0|2,0,0]=4 1867 B10R1.1 O=CCc1ccc(cc1)O 271570a_203496583355_100011361690 [1,1,0,0,0,0|1,0,0]=3 1868 B10R1.1 OCCc1ccc(cc1)O 271570a_203496583355_100000766406 [1,1,0,0,0,0|1,0,1]=4 1869 B10R1.1 Oc1ccc(cc1)/C=C/Br 271570a_203496583355_200016255901 [1,1,0,0,0,0|1,0,1]=4 1870 B10R1.1 Oc1ccc(cc1)NCF 34a_100000185829_100015361967 [1,1,0,0,0,0|2,0,0]=4 1871 B10R1.1 Oc1ccc(cc1)SCF 62a_100015361967_100000185759 [1,1,0,0,0,0|2,0,0]=4 1872 B10R1.1 [13CH3]NCc1ccc(cc1)Br 2230a_100000174875_200025704644 [1,1,0,0,0,0|1,0,1]=4 1873 B10R1.1 [13CH3]NCc1ccc(cc1)Br 34a_100000174875_200025704644 [1,1,0,0,0,0|1,0,1]=4 1874 B10R1.1 [13CH3]NCc1ccc(cc1)Cl 2230a_100000174871_200025704644 [1,1,0,0,0,0|1,0,1]=4 1875 B10R1.1 [13CH3]NCc1ccc(cc1)Cl 34a_100000174871_200025704644 [1,1,0,0,0,0|1,0,1]=4 1876 B10R1.1 [13CH3]NCc1ccc(cc1)F 2230a_100000174882_200025704644 [1,1,0,0,0,0|1,0,1]=4 1877 B10R1.1 [13CH3]NCc1ccc(cc1)F 34a_100000174882_200025704644 [1,1,0,0,0,0|1,0,1]=4 1878 B10R1.1 [13CH3]NCc1ccc(cc1)I 2230a_100016989417_200025704644 [1,1,0,0,0,0|1,0,1]=4 1879 B10R1.1 [13CH3]NCc1ccc(cc1)I 34a_100016989417_200025704644 [1,1,0,0,0,0|1,0,1]=4 1880 B10R1.1 [13CH3]NCc1ccc(cc1)O 34a_100000185549_200025704644 [1,1,0,0,0,0|1,0,1]=4 1881 B10R1.1 [13CH3]OCc1ccc(cc1)Br 34a_100000695286_200025704644 [1,1,0,0,0,0|1,0,1]=4 1882 B10R1.1 [13CH3]OCc1ccc(cc1)Cl 34a_100000211118_200025704644 [1,1,0,0,0,0|1,0,1]=4 1883 B10R1.1 [13CH3]OCc1ccc(cc1)Cl 7a_100000211118_200025704644 [1,1,0,0,0,0|1,0,1]=4 1884 B10R1.1 [13CH3]OCc1ccc(cc1)F 34a_100000210977_200025704644 [1,1,0,0,0,0|1,0,1]=4 1885 B10R1.1 [13CH3]OCc1ccc(cc1)F 7a_100000210977_200025704644 [1,1,0,0,0,0|1,0,1]=4 1886 B10R1.1 [13CH3]OCc1ccc(cc1)I 34a_100000690907_200025704644 [1,1,0,0,0,0|1,0,1]=4 1887 B10R1.1 [13CH3]OCc1ccc(cc1)I 7a_100000690907_200025704644 [1,1,0,0,0,0|1,0,1]=4 1888 B10R1.1 [13CH3]OCc1ccc(cc1)N 34a_100011215238_200025704644 [1,1,0,0,0,0|1,0,1]=4 1889 B10R1.1 [13CH3]SCc1ccc(cc1)Br 62a_100000189115_200025704644 [1,1,0,0,0,0|1,0,1]=4 1890 B10R1.1 [13CH3]SCc1ccc(cc1)Br 62a_200025704644_100000189115 [1,1,0,0,0,0|1,0,1]=4 1891 B10R1.1 [13CH3]SCc1ccc(cc1)Cl 62a_100000187161_200025704644 [1,1,0,0,0,0|1,0,1]=4 1892 B10R1.1 [13CH3]SCc1ccc(cc1)Cl 62a_200025704644_100000187161 [1,1,0,0,0,0|1,0,1]=4 1893 B10R1.1 [13CH3]SCc1ccc(cc1)F 62a_100000198546_200025704644 [1,1,0,0,0,0|1,0,1]=4 1894 B10R1.1 [13CH3]SCc1ccc(cc1)F 62a_200025704644_100000187164 [1,1,0,0,0,0|1,0,1]=4 1895 B10R1.1 [13CH3]SCc1ccc(cc1)I 62a_100000189116_200025704644 [1,1,0,0,0,0|1,0,1]=4 1896 B10R1.1 [13CH3]SCc1ccc(cc1)I 62a_200025704644_100000189116 [1,1,0,0,0,0|1,0,1]=4 1897 B10R1.3 C#Cc1ccc(cc1)NC 34a_100011215031_200000210301 [1,1,0,0,0,0|0,0,2]=4 1898 B10R1.3 C#Cc1ccc(cc1)N[13CH3] 34a_100011215031_200025704644 [1,1,0,0,0,0|0,0,2]=4 1899 B10R1.3 C=Cc1ccc(cc1)C#N 271570a_100011290941_100000179745 [1,1,0,0,0,0|0,0,2]=4 1900 B10R1.3 C=Cc1ccc(cc1)C=O 271570a_100011290941_100000186029 [1,1,0,0,0,0|0,0,1]=3 1901 B10R1.3 C=Cc1ccc(cc1)CC 271570a_100011290941_100011215824 [1,1,0,0,0,0|0,0,1]=3 1902 B10R1.3 C=Cc1ccc(cc1)CF 271570a_100011290941_100010268989 [1,1,0,0,0,0|0,0,1]=3 1903 B10R1.3 C=Cc1ccc(cc1)CN 271570a_100011290941_100016989417 [1,1,0,0,0,0|0,0,1]=3 1904 B10R1.3 C=Cc1ccc(cc1)CO 271570a_100011290941_100000690907 [1,1,0,0,0,0|0,0,1]=3 1905 B10R1.3 C=Cc1ccc(cc1)NC 271570a_100011290941_100000219623 [1,1,0,0,0,0|0,0,1]=3 1906 B10R1.3 C=Cc1ccc(cc1)NC 34a_100011218248_200000210301 [1,1,0,0,0,0|0,0,1]=3 1907 B10R1.3 C=Cc1ccc(cc1)NN 271570a_100011290941_100016988836 [1,1,0,0,0,0|1,0,1]=4 1908 B10R1.3 C=Cc1ccc(cc1)N[13CH3] 34a_100011218248_200025704644 [1,1,0,0,0,0|0,0,1]=3 1909 B10R1.3 C=Cc1ccc(cc1)OC 271570a_100011290941_100000171711 [1,1,0,0,0,0|0,0,1]=3 1910 B10R1.3 C=Cc1ccc(cc1)OC 34a_100000189437_200000210301 [1,1,0,0,0,0|0,0,1]=3 1911 B10R1.3 C=Cc1ccc(cc1)OC 7a_100000189437_200000210301 [1,1,0,0,0,0|0,0,1]=3 1912 B10R1.3 C=Cc1ccc(cc1)O[13CH3] 34a_100000189437_200025704644 [1,1,0,0,0,0|0,0,1]=3 1913 B10R1.3 C=Cc1ccc(cc1)O[13CH3] 7a_100000189437_200025704644 [1,1,0,0,0,0|0,0,1]=3 1914 B10R1.3 C=Cc1ccc(cc1)SC 271570a_100011290941_100011263217 [1,1,0,0,0,0|0,0,1]=3 1915 B10R1.3 C=Cc1ccc(cc1)SC 62a_100000748128_200000210301 [1,1,0,0,0,0|0,0,1]=3 1916 B10R1.3 C=Cc1ccc(cc1)SC 62a_200000210301_100000748128 [1,1,0,0,0,0|0,0,1]=3 1917 B10R1.3 C=Cc1ccc(cc1)S[13CH3] 62a_100000748128_200025704644 [1,1,0,0,0,0|0,0,1]=3 1918 B10R1.3 C=Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000748128 [1,1,0,0,0,0|0,0,1]=3 1919 B10R1.3 C=Cc1ccc(cn1)C=O 271570a_100011290941_100000766901 [1,1,0,0,0,0|1,0,1]=4 1920 B10R1.3 C=Cc1ccc(cn1)CC 271570a_100011290941_100009843584 [1,1,0,0,0,0|1,0,1]=4 1921 B10R1.3 C=Cc1ccc(cn1)CN 271570a_100011290941_100009817727 [1,1,0,0,0,0|1,0,1]=4 1922 B10R1.3 C=Cc1ccc(cn1)CO 271570a_100011290941_100009816760 [1,1,0,0,0,0|1,0,1]=4 1923 B10R1.3 C=Cc1ccc(cn1)NC 271570a_100011290941_100000764248 [1,1,0,0,0,0|1,0,1]=4 1924 B10R1.3 C=Cc1ccc(cn1)OC 271570a_100011290941_100000755202 [1,1,0,0,0,0|1,0,1]=4 1925 B10R1.3 C=Cc1ccc(cn1)SC 271570a_100011290941_100009820866 [1,1,0,0,0,0|1,0,1]=4 1926 B10R1.3 C=Cc1ccc(nc1)C=O 271570a_100011290941_100000754260 [1,1,0,0,0,0|1,0,1]=4 1927 B10R1.3 C=Cc1ccc(nc1)CC 271570a_100011290941_100009820025 [1,1,0,0,0,0|1,0,1]=4 1928 B10R1.3 C=Cc1ccc(nc1)CN 271570a_100011290941_100015188789 [1,1,0,0,0,0|1,0,1]=4 1929 B10R1.3 C=Cc1ccc(nc1)CO 271570a_100011290941_100000754261 [1,1,0,0,0,0|1,0,1]=4 1930 B10R1.3 C=Cc1ccc(nc1)NC 271570a_100011290941_100000741341 [1,1,0,0,0,0|1,0,1]=4 1931 B10R1.3 C=Cc1ccc(nc1)OC 271570a_100011290941_100000047065 [1,1,0,0,0,0|1,0,1]=4 1932 B10R1.3 C=Cc1ccc(nc1)SC 271570a_100011290941_100011408404 [1,1,0,0,0,0|1,0,1]=4 1933 B10R1.3 C=Cc1ccc(nc1)SC 62a_103436540071_200000210301 [1,1,0,0,0,0|1,0,1]=4 1934 B10R1.3 C=Cc1ccc(nc1)SC 62a_200000210301_103436540071 [1,1,0,0,0,0|1,0,1]=4 1935 B10R1.3 C=Cc1ccc(nc1)S[13CH3] 62a_103436540071_200025704644 [1,1,0,0,0,0|1,0,1]=4 1936 B10R1.3 C=Cc1ccc(nc1)S[13CH3] 62a_200025704644_103436540071 [1,1,0,0,0,0|1,0,1]=4 1937 B10R1.3 CCc1ccc(cc1)NC 2230a_100000211069_200000210301 [1,1,0,0,0,0|0,0,1]=3 1938 B10R1.3 CCc1ccc(cc1)NC 34a_100000211069_200000210301 [1,1,0,0,0,0|0,0,1]=3 1939 B10R1.3 CCc1ccc(cc1)N[13CH3] 2230a_100000211069_200025704644 [1,1,0,0,0,0|0,0,1]=3 1940 B10R1.3 CCc1ccc(cc1)N[13CH3] 34a_100000211069_200025704644 [1,1,0,0,0,0|0,0,1]=3 1941 B10R1.3 CCc1ccc(cc1)OC 34a_100000211359_200000210301 [1,1,0,0,0,0|0,0,1]=3 1942 B10R1.3 CCc1ccc(cc1)OC 7a_100000211359_200000210301 [1,1,0,0,0,0|0,0,1]=3 1943 B10R1.3 CCc1ccc(cc1)O[13CH3] 34a_100000211359_200025704644 [1,1,0,0,0,0|0,0,1]=3 1944 B10R1.3 CCc1ccc(cc1)O[13CH3] 7a_100000211359_200025704644 [1,1,0,0,0,0|0,0,1]=3 1945 B10R1.3 CCc1ccc(cc1)SC 62a_100011215824_200000210301 [1,1,0,0,0,0|0,0,1]=3 1946 B10R1.3 CCc1ccc(cc1)SC 62a_200000210301_100011215824 [1,1,0,0,0,0|0,0,1]=3 1947 B10R1.3 CCc1ccc(cc1)S[13CH3] 62a_100011215824_200025704644 [1,1,0,0,0,0|0,0,1]=3 1948 B10R1.3 CCc1ccc(cc1)S[13CH3] 62a_200025704644_100011215824 [1,1,0,0,0,0|0,0,1]=3 1949 B10R1.3 CCc1ccc(cn1)SC 62a_100009820025_200000210301 [1,1,0,0,0,0|1,0,1]=4 1950 B10R1.3 CCc1ccc(cn1)SC 62a_200000210301_100009820025 [1,1,0,0,0,0|1,0,1]=4 1951 B10R1.3 CCc1ccc(cn1)S[13CH3] 62a_100009820025_200025704644 [1,1,0,0,0,0|1,0,1]=4 1952 B10R1.3 CCc1ccc(cn1)S[13CH3] 62a_200025704644_100009820025 [1,1,0,0,0,0|1,0,1]=4 1953 B10R1.3 CCc1ccc(nc1)SC 62a_100009843584_200000210301 [1,1,0,0,0,0|1,0,1]=4 1954 B10R1.3 CCc1ccc(nc1)SC 62a_200000210301_100009843584 [1,1,0,0,0,0|1,0,1]=4 1955 B10R1.3 CCc1ccc(nc1)S[13CH3] 62a_100009843584_200025704644 [1,1,0,0,0,0|1,0,1]=4 1956 B10R1.3 CCc1ccc(nc1)S[13CH3] 62a_200025704644_100009843584 [1,1,0,0,0,0|1,0,1]=4 1957 B10R1.3 CNc1ccc(cc1)C#N 34a_100000185469_200000210301 [1,1,0,0,0,0|1,0,1]=4 1958 B10R1.3 CNc1ccc(cc1)CO 2230a_100011215238_200000210301 [1,1,0,0,0,0|1,0,0]=3 1959 B10R1.3 CNc1ccc(cc1)CO 34a_100011215238_200000210301 [1,1,0,0,0,0|1,0,0]=3 1960 B10R1.3 CNc1ccc(cc1)OC 34a_100000182112_200000210301 [1,1,0,0,0,0|1,0,0]=3 1961 B10R1.3 CNc1ccc(cc1)OC 34a_100000184247_200000210301 [1,1,0,0,0,0|1,0,0]=3 1962 B10R1.3 CNc1ccc(cc1)O[13CH3] 34a_100000182112_200025704644 [1,1,0,0,0,0|1,0,0]=3 1963 B10R1.3 CNc1ccc(cc1)SC 34a_100000212337_200000210301 [1,1,0,0,0,0|1,0,0]=3 1964 B10R1.3 CNc1ccc(cc1)SC 62a_100000743151_200000210301 [1,1,0,0,0,0|1,0,0]=3 1965 B10R1.3 CNc1ccc(cc1)SC 62a_200000210301_100000743151 [1,1,0,0,0,0|1,0,0]=3 1966 B10R1.3 CNc1ccc(cc1)S[13CH3] 62a_100000743151_200025704644 [1,1,0,0,0,0|1,0,0]=3 1967 B10R1.3 CNc1ccc(cc1)S[13CH3] 62a_200025704644_100000743151 [1,1,0,0,0,0|1,0,0]=3 1968 B10R1.3 CNc1ccc(cn1)SC 27a_100102657272_100009820866 [1,1,0,0,0,0|2,0,0]=4 1969 B10R1.3 CNc1ccc(cn1)SC 62a_100000741341_200000210301 [1,1,0,0,0,0|2,0,0]=4 1970 B10R1.3 CNc1ccc(cn1)SC 62a_200000210301_100000741341 [1,1,0,0,0,0|2,0,0]=4 1971 B10R1.3 CNc1ccc(cn1)S[13CH3] 62a_100000741341_200025704644 [1,1,0,0,0,0|2,0,0]=4 1972 B10R1.3 CNc1ccc(cn1)S[13CH3] 62a_200025704644_100000741341 [1,1,0,0,0,0|2,0,0]=4 1973 B10R1.3 CNc1ccc(nc1)SC 62a_100000764248_200000210301 [1,1,0,0,0,0|2,0,0]=4 1974 B10R1.3 CNc1ccc(nc1)SC 62a_200000210301_100000764248 [1,1,0,0,0,0|2,0,0]=4 1975 B10R1.3 CNc1ccc(nc1)S[13CH3] 62a_100000764248_200025704644 [1,1,0,0,0,0|2,0,0]=4 1976 B10R1.3 CNc1ccc(nc1)S[13CH3] 62a_200025704644_100000764248 [1,1,0,0,0,0|2,0,0]=4 1977 B10R1.3 CNc1cnc(cn1)C=O 27a_100102657272_100012001714 [1,1,0,0,0,0|2,0,0]=4 1978 B10R1.3 CNc1ncc(cn1)C=O 27a_100102657272_100000070856 [1,1,0,0,0,0|2,0,0]=4 1979 B10R1.3 COc1ccc(cc1)C#N 34a_100000210344_200000210301 [1,1,0,0,0,0|1,0,1]=4 1980 B10R1.3 COc1ccc(cc1)C#N 7a_100000210344_200000210301 [1,1,0,0,0,0|1,0,1]=4 1981 B10R1.3 COc1ccc(cc1)CN 34a_100000185549_200000210301 [1,1,0,0,0,0|1,0,0]=3 1982 B10R1.3 COc1ccc(cc1)CO 34a_100000211755_200000210301 [1,1,0,0,0,0|1,0,0]=3 1983 B10R1.3 COc1ccc(cc1)N[13CH3] 34a_100000184247_200025704644 [1,1,0,0,0,0|1,0,0]=3 1984 B10R1.3 COc1ccc(cc1)OC 34a_100000210503_200000210301 [1,1,0,0,0,0|1,0,0]=3 1985 B10R1.3 COc1ccc(cc1)O[13CH3] 34a_100000210503_200025704644 [1,1,0,0,0,0|1,0,0]=3 1986 B10R1.3 COc1ccc(cc1)SC 34a_100000211864_200000210301 [1,1,0,0,0,0|1,0,0]=3 1987 B10R1.3 COc1ccc(cc1)SC 62a_200000210301_100000171711 [1,1,0,0,0,0|1,0,0]=3 1988 B10R1.3 COc1ccc(cc1)S[13CH3] 62a_200025704644_100000171711 [1,1,0,0,0,0|1,0,0]=3 1989 B10R1.3 COc1ccc(cn1)CN 34a_100000757128_200000210301 [1,1,0,0,0,0|2,0,0]=4 1990 B10R1.3 COc1ccc(cn1)O[13CH3] 34a_100011934560_200025704644 [1,1,0,0,0,0|2,0,0]=4 1991 B10R1.3 COc1ccc(cn1)SC 62a_100000047065_200000210301 [1,1,0,0,0,0|2,0,0]=4 1992 B10R1.3 COc1ccc(cn1)SC 62a_200000210301_100000047065 [1,1,0,0,0,0|2,0,0]=4 1993 B10R1.3 COc1ccc(cn1)S[13CH3] 62a_100000047065_200025704644 [1,1,0,0,0,0|2,0,0]=4 1994 B10R1.3 COc1ccc(cn1)S[13CH3] 62a_200025704644_100000047065 [1,1,0,0,0,0|2,0,0]=4 1995 B10R1.3 COc1ccc(nc1)CN 34a_100020605196_200000210301 [1,1,0,0,0,0|2,0,0]=4 1996 B10R1.3 COc1ccc(nc1)CO 34a_103436540053_200000210301 [1,1,0,0,0,0|2,0,0]=4 1997 B10R1.3 COc1ccc(nc1)OC 34a_100011934560_200000210301 [1,1,0,0,0,0|2,0,0]=4 1998 B10R1.3 COc1ccc(nc1)OC 34a_100012002028_200000210301 [1,1,0,0,0,0|2,0,0]=4 1999 B10R1.3 COc1ccc(nc1)O[13CH3] 34a_100012002028_200025704644 [1,1,0,0,0,0|2,0,0]=4 2000 B10R1.3 COc1ccc(nc1)SC 62a_100000755202_200000210301 [1,1,0,0,0,0|2,0,0]=4 2001 B10R1.3 COc1ccc(nc1)SC 62a_200000210301_100000744180 [1,1,0,0,0,0|2,0,0]=4 2002 B10R1.3 COc1ccc(nc1)S[13CH3] 62a_100000755202_200025704644 [1,1,0,0,0,0|2,0,0]=4 2003 B10R1.3 COc1ccc(nc1)S[13CH3] 62a_200025704644_100000744180 [1,1,0,0,0,0|2,0,0]=4 2004 B10R1.3 CSc1ccc(cc1)C#N 62a_200000210301_100000184291 [1,1,0,0,0,0|1,0,1]=4 2005 B10R1.3 CSc1ccc(cc1)C=O 62a_100000188517_200000210301 [1,1,0,0,0,0|0,0,0]=2 2006 B10R1.3 CSc1ccc(cc1)C=O 62a_200000210301_100000188517 [1,1,0,0,0,0|0,0,0]=2 2007 B10R1.3 CSc1ccc(cc1)CF 62a_100010268989_200000210301 [1,1,0,0,0,0|1,0,0]=3 2008 B10R1.3 CSc1ccc(cc1)CF 62a_200000210301_100010268989 [1,1,0,0,0,0|1,0,0]=3 2009 B10R1.3 CSc1ccc(cc1)CN 62a_100016989417_200000210301 [1,1,0,0,0,0|1,0,0]=3 2010 B10R1.3 CSc1ccc(cc1)CN 62a_200000210301_100016989417 [1,1,0,0,0,0|1,0,0]=3 2011 B10R1.3 CSc1ccc(cc1)CO 62a_100000690907_200000210301 [1,1,0,0,0,0|1,0,0]=3 2012 B10R1.3 CSc1ccc(cc1)CO 62a_200000210301_100000690907 [1,1,0,0,0,0|1,0,0]=3 2013 B10R1.3 CSc1ccc(cc1)NN 62a_100016988836_200000210301 [1,1,0,0,0,0|2,0,0]=4 2014 B10R1.3 CSc1ccc(cc1)NN 62a_200000210301_100016988836 [1,1,0,0,0,0|2,0,0]=4 2015 B10R1.3 CSc1ccc(cc1)N[13CH3] 34a_100000212337_200025704644 [1,1,0,0,0,0|1,0,0]=3 2016 B10R1.3 CSc1ccc(cc1)O[13CH3] 34a_100000211864_200025704644 [1,1,0,0,0,0|1,0,0]=3 2017 B10R1.3 CSc1ccc(cc1)SC 62a_100011263217_200000210301 [1,1,0,0,0,0|1,0,0]=3 2018 B10R1.3 CSc1ccc(cc1)SC 62a_200000210301_100011263217 [1,1,0,0,0,0|1,0,0]=3 2019 B10R1.3 CSc1ccc(cc1)S[13CH3] 62a_100011263217_200025704644 [1,1,0,0,0,0|1,0,0]=3 2020 B10R1.3 CSc1ccc(cc1)S[13CH3] 62a_200025704644_100011263217 [1,1,0,0,0,0|1,0,0]=3 2021 B10R1.3 CSc1ccc(cn1)C=O 62a_100000766901_200000210301 [1,1,0,0,0,0|1,0,0]=3 2022 B10R1.3 CSc1ccc(cn1)C=O 62a_200000210301_100000766901 [1,1,0,0,0,0|1,0,0]=3 2023 B10R1.3 CSc1ccc(cn1)CN 62a_100000735879_200000210301 [1,1,0,0,0,0|2,0,0]=4 2024 B10R1.3 CSc1ccc(cn1)CN 62a_200000210301_100000735879 [1,1,0,0,0,0|2,0,0]=4 2025 B10R1.3 CSc1ccc(cn1)CO 62a_100009816760_200000210301 [1,1,0,0,0,0|2,0,0]=4 2026 B10R1.3 CSc1ccc(cn1)CO 62a_200000210301_100009816760 [1,1,0,0,0,0|2,0,0]=4 2027 B10R1.3 CSc1ccc(cn1)S[13CH3] 62a_100011408404_200025704644 [1,1,0,0,0,0|2,0,0]=4 2028 B10R1.3 CSc1ccc(cn1)S[13CH3] 62a_200025704644_100011408404 [1,1,0,0,0,0|2,0,0]=4 2029 B10R1.3 CSc1ccc(nc1)C=O 62a_100000754260_200000210301 [1,1,0,0,0,0|1,0,0]=3 2030 B10R1.3 CSc1ccc(nc1)C=O 62a_200000210301_100000754260 [1,1,0,0,0,0|1,0,0]=3 2031 B10R1.3 CSc1ccc(nc1)CN 62a_100015188789_200000210301 [1,1,0,0,0,0|2,0,0]=4 2032 B10R1.3 CSc1ccc(nc1)CN 62a_200000210301_100015188789 [1,1,0,0,0,0|2,0,0]=4 2033 B10R1.3 CSc1ccc(nc1)CO 62a_100000754261_200000210301 [1,1,0,0,0,0|2,0,0]=4 2034 B10R1.3 CSc1ccc(nc1)CO 62a_200000210301_100000754261 [1,1,0,0,0,0|2,0,0]=4 2035 B10R1.3 CSc1ccc(nc1)SC 62a_100009820866_200000210301 [1,1,0,0,0,0|2,0,0]=4 2036 B10R1.3 CSc1ccc(nc1)SC 62a_100011408404_200000210301 [1,1,0,0,0,0|2,0,0]=4 2037 B10R1.3 CSc1ccc(nc1)SC 62a_200000210301_100009820866 [1,1,0,0,0,0|2,0,0]=4 2038 B10R1.3 CSc1ccc(nc1)SC 62a_200000210301_100011408404 [1,1,0,0,0,0|2,0,0]=4 2039 B10R1.3 CSc1ccc(nc1)S[13CH3] 62a_100009820866_200025704644 [1,1,0,0,0,0|2,0,0]=4 2040 B10R1.3 CSc1ccc(nc1)S[13CH3] 62a_200025704644_100009820866 [1,1,0,0,0,0|2,0,0]=4 2041 B10R1.3 CSc1ccc(nn1)C=O 62a_100000044651_200000210301 [1,1,0,0,0,0|2,0,0]=4 2042 B10R1.3 CSc1ccc(nn1)C=O 62a_200000210301_100000044651 [1,1,0,0,0,0|2,0,0]=4 2043 B10R1.3 CSc1cnc(cn1)C=O 62a_100012001714_200000210301 [1,1,0,0,0,0|2,0,0]=4 2044 B10R1.3 CSc1cnc(cn1)C=O 62a_200000210301_100012001714 [1,1,0,0,0,0|2,0,0]=4 2045 B10R1.3 CSc1ncc(cn1)C=O 62a_100000070856_200000210301 [1,1,0,0,0,0|2,0,0]=4 2046 B10R1.3 CSc1ncc(cn1)C=O 62a_200000210301_100000070856 [1,1,0,0,0,0|2,0,0]=4 2047 B10R1.3 [13CH3]Nc1ccc(cc1)C#N 34a_100000185469_200025704644 [1,1,0,0,0,0|1,0,1]=4 2048 B10R1.3 [13CH3]Nc1ccc(cc1)CO 2230a_100011215238_200025704644 [1,1,0,0,0,0|1,0,0]=3 2049 B10R1.3 [13CH3]Nc1ccc(cc1)CO 34a_100011215238_200025704644 [1,1,0,0,0,0|1,0,0]=3 2050 B10R1.3 [13CH3]Oc1ccc(cc1)C#N 34a_100000210344_200025704644 [1,1,0,0,0,0|1,0,1]=4 2051 B10R1.3 [13CH3]Oc1ccc(cc1)C#N 7a_100000210344_200025704644 [1,1,0,0,0,0|1,0,1]=4 2052 B10R1.3 [13CH3]Oc1ccc(cc1)CN 34a_100000185549_200025704644 [1,1,0,0,0,0|1,0,0]=3 2053 B10R1.3 [13CH3]Oc1ccc(cc1)CO 34a_100000211755_200025704644 [1,1,0,0,0,0|1,0,0]=3 2054 B10R1.3 [13CH3]Oc1ccc(cn1)CN 34a_100000757128_200025704644 [1,1,0,0,0,0|2,0,0]=4 2055 B10R1.3 [13CH3]Oc1ccc(nc1)CN 34a_100020605196_200025704644 [1,1,0,0,0,0|2,0,0]=4 2056 B10R1.3 [13CH3]Oc1ccc(nc1)CO 34a_103436540053_200025704644 [1,1,0,0,0,0|2,0,0]=4 2057 B10R1.3 [13CH3]Sc1ccc(cc1)C#N 62a_200025704644_100000184291 [1,1,0,0,0,0|1,0,1]=4 2058 B10R1.3 [13CH3]Sc1ccc(cc1)C=O 62a_100000188517_200025704644 [1,1,0,0,0,0|0,0,0]=2 2059 B10R1.3 [13CH3]Sc1ccc(cc1)C=O 62a_200025704644_100000188517 [1,1,0,0,0,0|0,0,0]=2 2060 B10R1.3 [13CH3]Sc1ccc(cc1)CF 62a_100010268989_200025704644 [1,1,0,0,0,0|1,0,0]=3 2061 B10R1.3 [13CH3]Sc1ccc(cc1)CF 62a_200025704644_100010268989 [1,1,0,0,0,0|1,0,0]=3 2062 B10R1.3 [13CH3]Sc1ccc(cc1)CN 62a_100016989417_200025704644 [1,1,0,0,0,0|1,0,0]=3 2063 B10R1.3 [13CH3]Sc1ccc(cc1)CN 62a_200025704644_100016989417 [1,1,0,0,0,0|1,0,0]=3 2064 B10R1.3 [13CH3]Sc1ccc(cc1)CO 62a_100000690907_200025704644 [1,1,0,0,0,0|1,0,0]=3 2065 B10R1.3 [13CH3]Sc1ccc(cc1)CO 62a_200025704644_100000690907 [1,1,0,0,0,0|1,0,0]=3 2066 B10R1.3 [13CH3]Sc1ccc(cc1)NN 62a_100016988836_200025704644 [1,1,0,0,0,0|2,0,0]=4 2067 B10R1.3 [13CH3]Sc1ccc(cc1)NN 62a_200025704644_100016988836 [1,1,0,0,0,0|2,0,0]=4 2068 B10R1.3 [13CH3]Sc1ccc(cn1)C=O 62a_100000766901_200025704644 [1,1,0,0,0,0|1,0,0]=3 2069 B10R1.3 [13CH3]Sc1ccc(cn1)C=O 62a_200025704644_100000766901 [1,1,0,0,0,0|1,0,0]=3 2070 B10R1.3 [13CH3]Sc1ccc(cn1)CN 62a_100000735879_200025704644 [1,1,0,0,0,0|2,0,0]=4 2071 B10R1.3 [13CH3]Sc1ccc(cn1)CN 62a_200025704644_100000735879 [1,1,0,0,0,0|2,0,0]=4 2072 B10R1.3 [13CH3]Sc1ccc(cn1)CO 62a_100009816760_200025704644 [1,1,0,0,0,0|2,0,0]=4 2073 B10R1.3 [13CH3]Sc1ccc(cn1)CO 62a_200025704644_100009816760 [1,1,0,0,0,0|2,0,0]=4 2074 B10R1.3 [13CH3]Sc1ccc(nc1)C=O 62a_100000754260_200025704644 [1,1,0,0,0,0|1,0,0]=3 2075 B10R1.3 [13CH3]Sc1ccc(nc1)C=O 62a_200025704644_100000754260 [1,1,0,0,0,0|1,0,0]=3 2076 B10R1.3 [13CH3]Sc1ccc(nc1)CN 62a_100015188789_200025704644 [1,1,0,0,0,0|2,0,0]=4 2077 B10R1.3 [13CH3]Sc1ccc(nc1)CN 62a_200025704644_100015188789 [1,1,0,0,0,0|2,0,0]=4 2078 B10R1.3 [13CH3]Sc1ccc(nc1)CO 62a_100000754261_200025704644 [1,1,0,0,0,0|2,0,0]=4 2079 B10R1.3 [13CH3]Sc1ccc(nc1)CO 62a_200025704644_100000754261 [1,1,0,0,0,0|2,0,0]=4 2080 B10R1.3 [13CH3]Sc1ccc(nn1)C=O 62a_100000044651_200025704644 [1,1,0,0,0,0|2,0,0]=4 2081 B10R1.3 [13CH3]Sc1ccc(nn1)C=O 62a_200025704644_100000044651 [1,1,0,0,0,0|2,0,0]=4 2082 B10R1.3 [13CH3]Sc1cnc(cn1)C=O 62a_100012001714_200025704644 [1,1,0,0,0,0|2,0,0]=4 2083 B10R1.3 [13CH3]Sc1cnc(cn1)C=O 62a_200025704644_100012001714 [1,1,0,0,0,0|2,0,0]=4 2084 B10R1.3 [13CH3]Sc1ncc(cn1)C=O 62a_100000070856_200025704644 [1,1,0,0,0,0|2,0,0]=4 2085 B10R1.3 [13CH3]Sc1ncc(cn1)C=O 62a_200025704644_100000070856 [1,1,0,0,0,0|2,0,0]=4 2086 B10R1.25 C=Cc1ccc(c[n+]1[O-])C 271570a_100011290941_100009819918 [1,1,0,0,0,0|1,0,1]=4 2087 B10R1.25 C=Cc1ccc(cc1Br)Br 271570a_100011290941_100011484698 [1,1,0,0,0,0|1,0,1]=4 2088 B10R1.25 C=Cc1ccc(cc1Br)C 271570a_100011290941_100009813563 [1,1,0,0,0,0|0,0,1]=3 2089 B10R1.25 C=Cc1ccc(cc1Br)Cl 271570a_100011290941_100011219703 [1,1,0,0,0,0|1,0,1]=4 2090 B10R1.25 C=Cc1ccc(cc1Br)F 271570a_100011290941_100011217111 [1,1,0,0,0,0|1,0,1]=4 2091 B10R1.25 C=Cc1ccc(cc1Br)N 271570a_100011290941_100000750458 [1,1,0,0,0,0|1,0,1]=4 2092 B10R1.25 C=Cc1ccc(cc1Br)O 271570a_100011290941_100000701344 [1,1,0,0,0,0|1,0,1]=4 2093 B10R1.25 C=Cc1ccc(cc1C)Br 271570a_100011290941_100000701812 [1,1,0,0,0,0|1,0,1]=4 2094 B10R1.25 C=Cc1ccc(cc1C)C 271570a_100011290941_100011217332 [1,1,0,0,0,0|0,0,1]=3 2095 B10R1.25 C=Cc1ccc(cc1C)Cl 271570a_100011290941_100011219607 [1,1,0,0,0,0|1,0,1]=4 2096 B10R1.25 C=Cc1ccc(cc1C)F 271570a_100011290941_100011205405 [1,1,0,0,0,0|1,0,1]=4 2097 B10R1.25 C=Cc1ccc(cc1C)N 271570a_100011290941_100000210723 [1,1,0,0,0,0|1,0,1]=4 2098 B10R1.25 C=Cc1ccc(cc1C)O 271570a_100011290941_100000729255 [1,1,0,0,0,0|1,0,1]=4 2099 B10R1.25 C=Cc1ccc(cc1Cl)Br 271570a_100011290941_100011216062 [1,1,0,0,0,0|1,0,1]=4 2100 B10R1.25 C=Cc1ccc(cc1Cl)C 271570a_100011290941_100011263221 [1,1,0,0,0,0|0,0,1]=3 2101 B10R1.25 C=Cc1ccc(cc1Cl)Cl 271570a_100011290941_100000699841 [1,1,0,0,0,0|1,0,1]=4 2102 B10R1.25 C=Cc1ccc(cc1Cl)F 271570a_100011290941_100000733362 [1,1,0,0,0,0|1,0,1]=4 2103 B10R1.25 C=Cc1ccc(cc1Cl)N 271570a_100011290941_100000761885 [1,1,0,0,0,0|1,0,1]=4 2104 B10R1.25 C=Cc1ccc(cc1Cl)O 271570a_100011290941_100000047559 [1,1,0,0,0,0|1,0,1]=4 2105 B10R1.25 C=Cc1ccc(cc1F)Br 271570a_100011290941_100009814013 [1,1,0,0,0,0|1,0,1]=4 2106 B10R1.25 C=Cc1ccc(cc1F)C 271570a_100011290941_100011216119 [1,1,0,0,0,0|0,0,1]=3 2107 B10R1.25 C=Cc1ccc(cc1F)Cl 271570a_100011290941_100011216042 [1,1,0,0,0,0|1,0,1]=4 2108 B10R1.25 C=Cc1ccc(cc1F)F 271570a_100011290941_100000750030 [1,1,0,0,0,0|1,0,1]=4 2109 B10R1.25 C=Cc1ccc(cc1F)N 271570a_100011290941_100011356925 [1,1,0,0,0,0|1,0,1]=4 2110 B10R1.25 C=Cc1ccc(cc1F)O 271570a_100011290941_100000755031 [1,1,0,0,0,0|1,0,1]=4 2111 B10R1.25 C=Cc1ccc(cc1N)Br 271570a_100011290941_100000743836 [1,1,0,0,0,0|1,0,1]=4 2112 B10R1.25 C=Cc1ccc(cc1N)C 271570a_100011290941_100011216686 [1,1,0,0,0,0|0,0,1]=3 2113 B10R1.25 C=Cc1ccc(cc1N)Cl 271570a_100011290941_100000761886 [1,1,0,0,0,0|1,0,1]=4 2114 B10R1.25 C=Cc1ccc(cc1N)F 271570a_100011290941_100011218093 [1,1,0,0,0,0|1,0,1]=4 2115 B10R1.25 C=Cc1ccc(cc1N)N 271570a_100011290941_200012175722 [1,1,0,0,0,0|1,0,1]=4 2116 B10R1.25 C=Cc1ccc(cc1N)O 271570a_100011290941_100011999798 [1,1,0,0,0,0|1,0,1]=4 2117 B10R1.25 C=Cc1ccc(cc1O)Br 271570a_100011290941_100012344904 [1,1,0,0,0,0|1,0,1]=4 2118 B10R1.25 C=Cc1ccc(cc1O)C 271570a_100011290941_100012002257 [1,1,0,0,0,0|0,0,1]=3 2119 B10R1.25 C=Cc1ccc(cc1O)Cl 271570a_100011290941_100000050036 [1,1,0,0,0,0|1,0,1]=4 2120 B10R1.25 C=Cc1ccc(cc1O)F 271570a_100011290941_100000690578 [1,1,0,0,0,0|1,0,1]=4 2121 B10R1.25 C=Cc1ccc(cc1O)O 271570a_100011290941_100009813921 [1,1,0,0,0,0|1,0,1]=4 2122 B10R1.25 C=Cc1ccc(nc1C)C 271570a_100011290941_100009813853 [1,1,0,0,0,0|1,0,1]=4 2123 B10R1.25 C=Cc1ccc(nc1F)C 271570a_100011290941_100010006597 [1,1,0,0,0,0|1,0,1]=4 2124 B10R1.25 C=Cc1ccc(nc1N)C 271570a_100011290941_100009816662 [1,1,0,0,0,0|1,0,1]=4 2125 B10R1.25 C=Cc1ccc(nc1O)C 271570a_100011290941_100009817604 [1,1,0,0,0,0|1,0,1]=4 2126 B10R1.25 C=Cc1cnc(cc1C)C 271570a_100011290941_100009819613 [1,1,0,0,0,0|1,0,1]=4 2127 B10R1.25 C=Cc1cnc(cc1N)C 271570a_100011290941_100009817891 [1,1,0,0,0,0|1,0,1]=4 2128 B10R1.25 C=Cc1cnc(cc1O)C 271570a_100011290941_100011016184 [1,1,0,0,0,0|1,0,1]=4 2129 B10R1.25 C=Cc1ncc(cc1C)C 271570a_100011290941_100009864548 [1,1,0,0,0,0|1,0,1]=4 2130 B10R1.25 C=Cc1ncc(cc1F)C 271570a_100011290941_100009819633 [1,1,0,0,0,0|1,0,1]=4 2131 B10R1.25 C=Cc1ncc(cc1N)C 271570a_100011290941_100000733613 [1,1,0,0,0,0|1,0,1]=4 2132 B10R1.25 C=Cc1ncc(cc1O)C 271570a_100011290941_100012000487 [1,1,0,0,0,0|1,0,1]=4 2133 B10R1.25 CCc1ccc(cc1F)O 271570a_203496583355_200010071577 [1,1,0,0,0,0|1,0,1]=4 2134 B10R1.25 CCc1ccc(cc1N)O 271570a_203496583355_100012354963 [1,1,0,0,0,0|1,0,1]=4 2135 B10R1.25 CCc1cnc(cc1O)C 271570a_203496583355_100010291839 [1,1,0,0,0,0|1,0,1]=4 2136 B10R1.25 CNc1ccc(cc1Br)Br 34a_100000211012_200000210301 [1,1,0,0,0,0|2,0,0]=4 2137 B10R1.25 CNc1ccc(cc1Br)C 34a_100000210942_200000210301 [1,1,0,0,0,0|1,0,0]=3 2138 B10R1.25 CNc1ccc(cc1Br)Cl 34a_100000752454_200000210301 [1,1,0,0,0,0|2,0,0]=4 2139 B10R1.25 CNc1ccc(cc1Br)F 34a_100000738039_200000210301 [1,1,0,0,0,0|2,0,0]=4 2140 B10R1.25 CNc1ccc(cc1Br)O 34a_100012001276_200000210301 [1,1,0,0,0,0|2,0,0]=4 2141 B10R1.25 CNc1ccc(cc1C)Br 34a_100000211769_200000210301 [1,1,0,0,0,0|2,0,0]=4 2142 B10R1.25 CNc1ccc(cc1C)Br 7a_100000211769_200000210301 [1,1,0,0,0,0|2,0,0]=4 2143 B10R1.25 CNc1ccc(cc1C)C 34a_100000736561_200000210301 [1,1,0,0,0,0|1,0,0]=3 2144 B10R1.25 CNc1ccc(cc1C)C 7a_100000736561_200000210301 [1,1,0,0,0,0|1,0,0]=3 2145 B10R1.25 CNc1ccc(cc1C)Cl 34a_100000210418_200000210301 [1,1,0,0,0,0|2,0,0]=4 2146 B10R1.25 CNc1ccc(cc1C)Cl 7a_100000210418_200000210301 [1,1,0,0,0,0|2,0,0]=4 2147 B10R1.25 CNc1ccc(cc1C)F 34a_100000211637_200000210301 [1,1,0,0,0,0|2,0,0]=4 2148 B10R1.25 CNc1ccc(cc1C)F 7a_100000211637_200000210301 [1,1,0,0,0,0|2,0,0]=4 2149 B10R1.25 CNc1ccc(cc1C)I 34a_100000184554_200000210301 [1,1,0,0,0,0|2,0,0]=4 2150 B10R1.25 CNc1ccc(cc1C)I 7a_100000184554_200000210301 [1,1,0,0,0,0|2,0,0]=4 2151 B10R1.25 CNc1ccc(cc1C)O 271570a_203496583355_100000221803 [1,1,0,0,0,0|2,0,0]=4 2152 B10R1.25 CNc1ccc(cc1C)O 34a_100000756630_200000210301 [1,1,0,0,0,0|2,0,0]=4 2153 B10R1.25 CNc1ccc(cc1Cl)Br 34a_100000211467_200000210301 [1,1,0,0,0,0|2,0,0]=4 2154 B10R1.25 CNc1ccc(cc1Cl)C 34a_100000210522_200000210301 [1,1,0,0,0,0|1,0,0]=3 2155 B10R1.25 CNc1ccc(cc1Cl)Cl 34a_100000185861_200000210301 [1,1,0,0,0,0|2,0,0]=4 2156 B10R1.25 CNc1ccc(cc1Cl)F 34a_100000212003_200000210301 [1,1,0,0,0,0|2,0,0]=4 2157 B10R1.25 CNc1ccc(cc1Cl)I 34a_100011218065_200000210301 [1,1,0,0,0,0|2,0,0]=4 2158 B10R1.25 CNc1ccc(cc1Cl)O 34a_100011215599_200000210301 [1,1,0,0,0,0|2,0,0]=4 2159 B10R1.25 CNc1ccc(cc1F)Br 34a_100000210722_200000210301 [1,1,0,0,0,0|2,0,0]=4 2160 B10R1.25 CNc1ccc(cc1F)C 34a_100000211023_200000210301 [1,1,0,0,0,0|1,0,0]=3 2161 B10R1.25 CNc1ccc(cc1F)Cl 34a_100000211020_200000210301 [1,1,0,0,0,0|2,0,0]=4 2162 B10R1.25 CNc1ccc(cc1F)F 34a_100000210720_200000210301 [1,1,0,0,0,0|2,0,0]=4 2163 B10R1.25 CNc1ccc(cc1F)I 34a_100011215594_200000210301 [1,1,0,0,0,0|2,0,0]=4 2164 B10R1.25 CNc1ccc(cc1F)O 271570a_203496583355_100000743884 [1,1,0,0,0,0|2,0,0]=4 2165 B10R1.25 CNc1ccc(cc1F)O 34a_100000759473_200000210301 [1,1,0,0,0,0|2,0,0]=4 2166 B10R1.25 CNc1ccc(cc1I)Br 34a_100000187925_200000210301 [1,1,0,0,0,0|2,0,0]=4 2167 B10R1.25 CNc1ccc(cc1I)C 34a_100011356834_200000210301 [1,1,0,0,0,0|1,0,0]=3 2168 B10R1.25 CNc1ccc(cc1I)Cl 34a_100000761889_200000210301 [1,1,0,0,0,0|2,0,0]=4 2169 B10R1.25 CNc1ccc(cc1I)F 34a_100000760547_200000210301 [1,1,0,0,0,0|2,0,0]=4 2170 B10R1.25 CNc1ccc(cc1I)O 34a_100010084370_200000210301 [1,1,0,0,0,0|2,0,0]=4 2171 B10R1.25 CNc1ccc(cc1N)O 271570a_203496583355_100000741790 [1,1,0,0,0,0|2,0,0]=4 2172 B10R1.25 CNc1ccc(cc1O)Br 34a_100000739049_200000210301 [1,1,0,0,0,0|2,0,0]=4 2173 B10R1.25 CNc1ccc(cc1O)C 271570a_203496583355_100000221369 [1,1,0,0,0,0|1,0,0]=3 2174 B10R1.25 CNc1ccc(cc1O)C 34a_100000211527_200000210301 [1,1,0,0,0,0|1,0,0]=3 2175 B10R1.25 CNc1ccc(cc1O)Cl 34a_100000185728_200000210301 [1,1,0,0,0,0|2,0,0]=4 2176 B10R1.25 CNc1ccc(cc1O)F 271570a_203496583355_100011246292 [1,1,0,0,0,0|2,0,0]=4 2177 B10R1.25 CNc1ccc(cc1O)F 34a_100000753323_200000210301 [1,1,0,0,0,0|2,0,0]=4 2178 B10R1.25 CNc1ccc(cc1O)O 34a_100000106777_200000210301 [1,1,0,0,0,0|2,0,0]=4 2179 B10R1.25 COc1ccc(cc1Br)Br 34a_100000188717_200000210301 [1,1,0,0,0,0|2,0,0]=4 2180 B10R1.25 COc1ccc(cc1Br)Br 7a_100000188717_200000210301 [1,1,0,0,0,0|2,0,0]=4 2181 B10R1.25 COc1ccc(cc1Br)C 34a_100000210800_200000210301 [1,1,0,0,0,0|1,0,0]=3 2182 B10R1.25 COc1ccc(cc1Br)C 7a_100000210800_200000210301 [1,1,0,0,0,0|1,0,0]=3 2183 B10R1.25 COc1ccc(cc1Br)Cl 34a_100000211998_200000210301 [1,1,0,0,0,0|2,0,0]=4 2184 B10R1.25 COc1ccc(cc1Br)Cl 7a_100000211998_200000210301 [1,1,0,0,0,0|2,0,0]=4 2185 B10R1.25 COc1ccc(cc1Br)F 34a_100000211999_200000210301 [1,1,0,0,0,0|2,0,0]=4 2186 B10R1.25 COc1ccc(cc1Br)F 7a_100000211999_200000210301 [1,1,0,0,0,0|2,0,0]=4 2187 B10R1.25 COc1ccc(cc1Br)I 34a_100012361655_200000210301 [1,1,0,0,0,0|2,0,0]=4 2188 B10R1.25 COc1ccc(cc1Br)I 7a_100012361655_200000210301 [1,1,0,0,0,0|2,0,0]=4 2189 B10R1.25 COc1ccc(cc1Br)N 34a_100011534360_200000210301 [1,1,0,0,0,0|2,0,0]=4 2190 B10R1.25 COc1ccc(cc1Br)N 7a_100011534360_200000210301 [1,1,0,0,0,0|2,0,0]=4 2191 B10R1.25 COc1ccc(cc1Br)O 271570a_203496583355_100011249507 [1,1,0,0,0,0|2,0,0]=4 2192 B10R1.25 COc1ccc(cc1C)Br 34a_100000186361_200000210301 [1,1,0,0,0,0|2,0,0]=4 2193 B10R1.25 COc1ccc(cc1C)Br 7a_100000186361_200000210301 [1,1,0,0,0,0|2,0,0]=4 2194 B10R1.25 COc1ccc(cc1C)C 34a_100000211776_200000210301 [1,1,0,0,0,0|1,0,0]=3 2195 B10R1.25 COc1ccc(cc1C)C 7a_100000211776_200000210301 [1,1,0,0,0,0|1,0,0]=3 2196 B10R1.25 COc1ccc(cc1C)Cl 34a_100000211091_200000210301 [1,1,0,0,0,0|2,0,0]=4 2197 B10R1.25 COc1ccc(cc1C)Cl 7a_100000211091_200000210301 [1,1,0,0,0,0|2,0,0]=4 2198 B10R1.25 COc1ccc(cc1C)F 34a_100000764316_200000210301 [1,1,0,0,0,0|2,0,0]=4 2199 B10R1.25 COc1ccc(cc1C)F 7a_100000764316_200000210301 [1,1,0,0,0,0|2,0,0]=4 2200 B10R1.25 COc1ccc(cc1C)I 34a_100011218673_200000210301 [1,1,0,0,0,0|2,0,0]=4 2201 B10R1.25 COc1ccc(cc1C)I 7a_100011218673_200000210301 [1,1,0,0,0,0|2,0,0]=4 2202 B10R1.25 COc1ccc(cc1C)N 34a_100011218179_200000210301 [1,1,0,0,0,0|2,0,0]=4 2203 B10R1.25 COc1ccc(cc1C)N 7a_100011218179_200000210301 [1,1,0,0,0,0|2,0,0]=4 2204 B10R1.25 COc1ccc(cc1C)O 271570a_203496583355_100011219705 [1,1,0,0,0,0|2,0,0]=4 2205 B10R1.25 COc1ccc(cc1Cl)Br 34a_100000186472_200000210301 [1,1,0,0,0,0|2,0,0]=4 2206 B10R1.25 COc1ccc(cc1Cl)Br 7a_100000186472_200000210301 [1,1,0,0,0,0|2,0,0]=4 2207 B10R1.25 COc1ccc(cc1Cl)C 34a_100000749699_200000210301 [1,1,0,0,0,0|1,0,0]=3 2208 B10R1.25 COc1ccc(cc1Cl)C 7a_100000749699_200000210301 [1,1,0,0,0,0|1,0,0]=3 2209 B10R1.25 COc1ccc(cc1Cl)Cl 34a_100015191787_200000210301 [1,1,0,0,0,0|2,0,0]=4 2210 B10R1.25 COc1ccc(cc1Cl)Cl 7a_100015191787_200000210301 [1,1,0,0,0,0|2,0,0]=4 2211 B10R1.25 COc1ccc(cc1Cl)F 34a_100000212004_200000210301 [1,1,0,0,0,0|2,0,0]=4 2212 B10R1.25 COc1ccc(cc1Cl)F 7a_100000212004_200000210301 [1,1,0,0,0,0|2,0,0]=4 2213 B10R1.25 COc1ccc(cc1Cl)I 34a_100012360047_200000210301 [1,1,0,0,0,0|2,0,0]=4 2214 B10R1.25 COc1ccc(cc1Cl)I 7a_100012360047_200000210301 [1,1,0,0,0,0|2,0,0]=4 2215 B10R1.25 COc1ccc(cc1Cl)N 34a_100000744943_200000210301 [1,1,0,0,0,0|2,0,0]=4 2216 B10R1.25 COc1ccc(cc1Cl)N 7a_100000744943_200000210301 [1,1,0,0,0,0|2,0,0]=4 2217 B10R1.25 COc1ccc(cc1Cl)O 271570a_203496583355_100012355395 [1,1,0,0,0,0|2,0,0]=4 2218 B10R1.25 COc1ccc(cc1F)Br 34a_100000185481_200000210301 [1,1,0,0,0,0|2,0,0]=4 2219 B10R1.25 COc1ccc(cc1F)Br 7a_100000185481_200000210301 [1,1,0,0,0,0|2,0,0]=4 2220 B10R1.25 COc1ccc(cc1F)C 34a_100011216688_200000210301 [1,1,0,0,0,0|1,0,0]=3 2221 B10R1.25 COc1ccc(cc1F)C 7a_100011216688_200000210301 [1,1,0,0,0,0|1,0,0]=3 2222 B10R1.25 COc1ccc(cc1F)Cl 34a_100000230166_200000210301 [1,1,0,0,0,0|2,0,0]=4 2223 B10R1.25 COc1ccc(cc1F)Cl 7a_100000230166_200000210301 [1,1,0,0,0,0|2,0,0]=4 2224 B10R1.25 COc1ccc(cc1F)F 34a_100000230127_200000210301 [1,1,0,0,0,0|2,0,0]=4 2225 B10R1.25 COc1ccc(cc1F)F 7a_100000230127_200000210301 [1,1,0,0,0,0|2,0,0]=4 2226 B10R1.25 COc1ccc(cc1F)I 34a_100011356965_200000210301 [1,1,0,0,0,0|2,0,0]=4 2227 B10R1.25 COc1ccc(cc1F)I 7a_100011356965_200000210301 [1,1,0,0,0,0|2,0,0]=4 2228 B10R1.25 COc1ccc(cc1F)N 34a_100011220035_200000210301 [1,1,0,0,0,0|2,0,0]=4 2229 B10R1.25 COc1ccc(cc1F)N 7a_100011220035_200000210301 [1,1,0,0,0,0|2,0,0]=4 2230 B10R1.25 COc1ccc(cc1F)O 271570a_203496583355_100000185480 [1,1,0,0,0,0|2,0,0]=4 2231 B10R1.25 COc1ccc(cc1I)Br 34a_100012355227_200000210301 [1,1,0,0,0,0|2,0,0]=4 2232 B10R1.25 COc1ccc(cc1I)Br 7a_100012355227_200000210301 [1,1,0,0,0,0|2,0,0]=4 2233 B10R1.25 COc1ccc(cc1I)C 34a_100000765521_200000210301 [1,1,0,0,0,0|1,0,0]=3 2234 B10R1.25 COc1ccc(cc1I)C 7a_100000765521_200000210301 [1,1,0,0,0,0|1,0,0]=3 2235 B10R1.25 COc1ccc(cc1I)Cl 34a_100011356953_200000210301 [1,1,0,0,0,0|2,0,0]=4 2236 B10R1.25 COc1ccc(cc1I)Cl 7a_100011356953_200000210301 [1,1,0,0,0,0|2,0,0]=4 2237 B10R1.25 COc1ccc(cc1I)F 34a_100012355409_200000210301 [1,1,0,0,0,0|2,0,0]=4 2238 B10R1.25 COc1ccc(cc1I)F 7a_100012355409_200000210301 [1,1,0,0,0,0|2,0,0]=4 2239 B10R1.25 COc1ccc(cc1I)I 7a_100010001573_200000210301 [1,1,0,0,0,0|2,0,0]=4 2240 B10R1.25 COc1ccc(cc1N)Br 34a_100000752626_200000210301 [1,1,0,0,0,0|2,0,0]=4 2241 B10R1.25 COc1ccc(cc1N)Br 7a_100000752626_200000210301 [1,1,0,0,0,0|2,0,0]=4 2242 B10R1.25 COc1ccc(cc1N)C 34a_100011215204_200000210301 [1,1,0,0,0,0|1,0,0]=3 2243 B10R1.25 COc1ccc(cc1N)C 7a_100011215204_200000210301 [1,1,0,0,0,0|1,0,0]=3 2244 B10R1.25 COc1ccc(cc1N)Cl 34a_100000210500_200000210301 [1,1,0,0,0,0|2,0,0]=4 2245 B10R1.25 COc1ccc(cc1N)Cl 7a_100000210500_200000210301 [1,1,0,0,0,0|2,0,0]=4 2246 B10R1.25 COc1ccc(cc1N)F 34a_100000759472_200000210301 [1,1,0,0,0,0|2,0,0]=4 2247 B10R1.25 COc1ccc(cc1N)F 7a_100000759472_200000210301 [1,1,0,0,0,0|2,0,0]=4 2248 B10R1.25 COc1ccc(cc1N)I 34a_100000753495_200000210301 [1,1,0,0,0,0|2,0,0]=4 2249 B10R1.25 COc1ccc(cc1N)I 7a_100000753495_200000210301 [1,1,0,0,0,0|2,0,0]=4 2250 B10R1.25 COc1ccc(cc1N)N 34a_100000725306_200000210301 [1,1,0,0,0,0|2,0,0]=4 2251 B10R1.25 COc1ccc(cc1N)O 271570a_203496583355_100000743470 [1,1,0,0,0,0|2,0,0]=4 2252 B10R1.25 COc1ccc(cc1O)Br 271570a_203496583355_100012351588 [1,1,0,0,0,0|2,0,0]=4 2253 B10R1.25 COc1ccc(cc1O)C 271570a_203496583355_100000186399 [1,1,0,0,0,0|1,0,0]=3 2254 B10R1.25 COc1ccc(cc1O)Cl 271570a_203496583355_100011215930 [1,1,0,0,0,0|2,0,0]=4 2255 B10R1.25 COc1ccc(cc1O)F 271570a_203496583355_100000171694 [1,1,0,0,0,0|2,0,0]=4 2256 B10R1.25 COc1ccc(cc1O)N 271570a_203496583355_100000187427 [1,1,0,0,0,0|2,0,0]=4 2257 B10R1.25 COc1ccc(cc1O)O 271570a_203496583355_100009816560 [1,1,0,0,0,0|2,0,0]=4 2258 B10R1.25 COc1ccc(cc1O)O 271570a_203496583355_100010084122 [1,1,0,0,0,0|2,0,0]=4 2259 B10R1.25 COc1ccc(nc1Br)C 34a_100000702858_200000210301 [1,1,0,0,0,0|2,0,0]=4 2260 B10R1.25 COc1ccc(nc1Br)C 7a_100000702858_200000210301 [1,1,0,0,0,0|2,0,0]=4 2261 B10R1.25 COc1ccc(nc1C)C 34a_100011218912_200000210301 [1,1,0,0,0,0|2,0,0]=4 2262 B10R1.25 COc1ccc(nc1C)C 7a_100011218912_200000210301 [1,1,0,0,0,0|2,0,0]=4 2263 B10R1.25 COc1ccc(nc1Cl)C 34a_100000086286_200000210301 [1,1,0,0,0,0|2,0,0]=4 2264 B10R1.25 COc1ccc(nc1Cl)C 7a_100000086286_200000210301 [1,1,0,0,0,0|2,0,0]=4 2265 B10R1.25 COc1ccc(nc1F)C 34a_100000079963_200000210301 [1,1,0,0,0,0|2,0,0]=4 2266 B10R1.25 COc1ccc(nc1F)C 7a_100000079963_200000210301 [1,1,0,0,0,0|2,0,0]=4 2267 B10R1.25 COc1ccc(nc1I)C 34a_100000023897_200000210301 [1,1,0,0,0,0|2,0,0]=4 2268 B10R1.25 COc1ccc(nc1I)C 7a_100000023897_200000210301 [1,1,0,0,0,0|2,0,0]=4 2269 B10R1.25 COc1ccc(nc1N)C 34a_100000694039_200000210301 [1,1,0,0,0,0|2,0,0]=4 2270 B10R1.25 COc1ccc(nc1N)C 7a_100000694039_200000210301 [1,1,0,0,0,0|2,0,0]=4 2271 B10R1.25 COc1ccc(nc1O)C 271570a_203496583355_100009820875 [1,1,0,0,0,0|2,0,0]=4 2272 B10R1.25 COc1cnc(cc1Br)C 34a_100009843476_200000210301 [1,1,0,0,0,0|2,0,0]=4 2273 B10R1.25 COc1cnc(cc1Br)C 7a_100009843476_200000210301 [1,1,0,0,0,0|2,0,0]=4 2274 B10R1.25 COc1cnc(cc1C)C 34a_200000068632_200000210301 [1,1,0,0,0,0|2,0,0]=4 2275 B10R1.25 COc1cnc(cc1C)C 7a_200000068632_200000210301 [1,1,0,0,0,0|2,0,0]=4 2276 B10R1.25 COc1cnc(cc1O)C 271570a_203496583355_100010109759 [1,1,0,0,0,0|2,0,0]=4 2277 B10R1.25 COc1coc(cc1=O)C 34a_100000081520_200000210301 [1,1,0,0,0,0|2,0,0]=4 2278 B10R1.25 COc1ncc(cc1Br)C 34a_100000719714_200000210301 [1,1,0,0,0,0|2,0,0]=4 2279 B10R1.25 COc1ncc(cc1N)C 34a_100012000488_200000210301 [1,1,0,0,0,0|2,0,0]=4 2280 B10R1.25 COc1ncc(cc1O)C 271570a_203496583355_100012353929 [1,1,0,0,0,0|2,0,0]=4 2281 B10R1.25 CSc1ccc(c[n+]1[O-])C 62a_200000210301_100009819918 [1,1,0,0,0,0|2,0,0]=4 2282 B10R1.25 CSc1ccc(cc1Br)Br 62a_100011484698_200000210301 [1,1,0,0,0,0|2,0,0]=4 2283 B10R1.25 CSc1ccc(cc1Br)Br 62a_200000210301_100011484698 [1,1,0,0,0,0|2,0,0]=4 2284 B10R1.25 CSc1ccc(cc1Br)C 62a_100009813563_200000210301 [1,1,0,0,0,0|1,0,0]=3 2285 B10R1.25 CSc1ccc(cc1Br)C 62a_200000210301_100009813563 [1,1,0,0,0,0|1,0,0]=3 2286 B10R1.25 CSc1ccc(cc1Br)Cl 62a_100011219703_200000210301 [1,1,0,0,0,0|2,0,0]=4 2287 B10R1.25 CSc1ccc(cc1Br)Cl 62a_200000210301_100011219703 [1,1,0,0,0,0|2,0,0]=4 2288 B10R1.25 CSc1ccc(cc1Br)F 62a_100011217111_200000210301 [1,1,0,0,0,0|2,0,0]=4 2289 B10R1.25 CSc1ccc(cc1Br)F 62a_200000210301_100011217111 [1,1,0,0,0,0|2,0,0]=4 2290 B10R1.25 CSc1ccc(cc1Br)N 62a_100000750458_200000210301 [1,1,0,0,0,0|2,0,0]=4 2291 B10R1.25 CSc1ccc(cc1Br)N 62a_200000210301_100000750458 [1,1,0,0,0,0|2,0,0]=4 2292 B10R1.25 CSc1ccc(cc1Br)O 62a_100000701344_200000210301 [1,1,0,0,0,0|2,0,0]=4 2293 B10R1.25 CSc1ccc(cc1Br)O 62a_200000210301_100000701344 [1,1,0,0,0,0|2,0,0]=4 2294 B10R1.25 CSc1ccc(cc1C)Br 62a_100000701812_200000210301 [1,1,0,0,0,0|2,0,0]=4 2295 B10R1.25 CSc1ccc(cc1C)Br 62a_200000210301_100000701812 [1,1,0,0,0,0|2,0,0]=4 2296 B10R1.25 CSc1ccc(cc1C)C 62a_100011217332_200000210301 [1,1,0,0,0,0|1,0,0]=3 2297 B10R1.25 CSc1ccc(cc1C)C 62a_200000210301_100011217332 [1,1,0,0,0,0|1,0,0]=3 2298 B10R1.25 CSc1ccc(cc1C)Cl 62a_100011219607_200000210301 [1,1,0,0,0,0|2,0,0]=4 2299 B10R1.25 CSc1ccc(cc1C)Cl 62a_200000210301_100011219607 [1,1,0,0,0,0|2,0,0]=4 2300 B10R1.25 CSc1ccc(cc1C)F 62a_100011205405_200000210301 [1,1,0,0,0,0|2,0,0]=4 2301 B10R1.25 CSc1ccc(cc1C)F 62a_200000210301_100011205405 [1,1,0,0,0,0|2,0,0]=4 2302 B10R1.25 CSc1ccc(cc1C)N 62a_100000210723_200000210301 [1,1,0,0,0,0|2,0,0]=4 2303 B10R1.25 CSc1ccc(cc1C)N 62a_200000210301_100000210723 [1,1,0,0,0,0|2,0,0]=4 2304 B10R1.25 CSc1ccc(cc1C)O 62a_200000210301_100000690111 [1,1,0,0,0,0|2,0,0]=4 2305 B10R1.25 CSc1ccc(cc1Cl)Br 62a_100011216062_200000210301 [1,1,0,0,0,0|2,0,0]=4 2306 B10R1.25 CSc1ccc(cc1Cl)Br 62a_200000210301_100011216062 [1,1,0,0,0,0|2,0,0]=4 2307 B10R1.25 CSc1ccc(cc1Cl)C 62a_100011263221_200000210301 [1,1,0,0,0,0|1,0,0]=3 2308 B10R1.25 CSc1ccc(cc1Cl)C 62a_200000210301_100011263221 [1,1,0,0,0,0|1,0,0]=3 2309 B10R1.25 CSc1ccc(cc1Cl)Cl 62a_100000699841_200000210301 [1,1,0,0,0,0|2,0,0]=4 2310 B10R1.25 CSc1ccc(cc1Cl)Cl 62a_200000210301_100000699841 [1,1,0,0,0,0|2,0,0]=4 2311 B10R1.25 CSc1ccc(cc1Cl)F 62a_100000733362_200000210301 [1,1,0,0,0,0|2,0,0]=4 2312 B10R1.25 CSc1ccc(cc1Cl)F 62a_200000210301_100000733362 [1,1,0,0,0,0|2,0,0]=4 2313 B10R1.25 CSc1ccc(cc1Cl)N 62a_100000761885_200000210301 [1,1,0,0,0,0|2,0,0]=4 2314 B10R1.25 CSc1ccc(cc1Cl)N 62a_200000210301_100000761885 [1,1,0,0,0,0|2,0,0]=4 2315 B10R1.25 CSc1ccc(cc1Cl)O 271570a_203496583355_206447510565 [1,1,0,0,0,0|2,0,0]=4 2316 B10R1.25 CSc1ccc(cc1Cl)O 62a_100000047559_200000210301 [1,1,0,0,0,0|2,0,0]=4 2317 B10R1.25 CSc1ccc(cc1Cl)O 62a_200000210301_100000047559 [1,1,0,0,0,0|2,0,0]=4 2318 B10R1.25 CSc1ccc(cc1F)Br 62a_100009814013_200000210301 [1,1,0,0,0,0|2,0,0]=4 2319 B10R1.25 CSc1ccc(cc1F)Br 62a_200000210301_100009814013 [1,1,0,0,0,0|2,0,0]=4 2320 B10R1.25 CSc1ccc(cc1F)C 62a_100011216119_200000210301 [1,1,0,0,0,0|1,0,0]=3 2321 B10R1.25 CSc1ccc(cc1F)C 62a_200000210301_100011216119 [1,1,0,0,0,0|1,0,0]=3 2322 B10R1.25 CSc1ccc(cc1F)Cl 62a_100011216042_200000210301 [1,1,0,0,0,0|2,0,0]=4 2323 B10R1.25 CSc1ccc(cc1F)Cl 62a_200000210301_100011216042 [1,1,0,0,0,0|2,0,0]=4 2324 B10R1.25 CSc1ccc(cc1F)F 62a_100000750030_200000210301 [1,1,0,0,0,0|2,0,0]=4 2325 B10R1.25 CSc1ccc(cc1F)F 62a_200000210301_100000750030 [1,1,0,0,0,0|2,0,0]=4 2326 B10R1.25 CSc1ccc(cc1F)N 62a_100011356925_200000210301 [1,1,0,0,0,0|2,0,0]=4 2327 B10R1.25 CSc1ccc(cc1F)N 62a_200000210301_100011356925 [1,1,0,0,0,0|2,0,0]=4 2328 B10R1.25 CSc1ccc(cc1F)O 271570a_203496583355_100010161220 [1,1,0,0,0,0|2,0,0]=4 2329 B10R1.25 CSc1ccc(cc1F)O 62a_100000755031_200000210301 [1,1,0,0,0,0|2,0,0]=4 2330 B10R1.25 CSc1ccc(cc1F)O 62a_200000210301_100000755031 [1,1,0,0,0,0|2,0,0]=4 2331 B10R1.25 CSc1ccc(cc1N)Br 62a_100000743836_200000210301 [1,1,0,0,0,0|2,0,0]=4 2332 B10R1.25 CSc1ccc(cc1N)Br 62a_200000210301_100000743836 [1,1,0,0,0,0|2,0,0]=4 2333 B10R1.25 CSc1ccc(cc1N)C 62a_100011216686_200000210301 [1,1,0,0,0,0|1,0,0]=3 2334 B10R1.25 CSc1ccc(cc1N)C 62a_200000210301_100011216686 [1,1,0,0,0,0|1,0,0]=3 2335 B10R1.25 CSc1ccc(cc1N)Cl 62a_100000761886_200000210301 [1,1,0,0,0,0|2,0,0]=4 2336 B10R1.25 CSc1ccc(cc1N)Cl 62a_200000210301_100000761886 [1,1,0,0,0,0|2,0,0]=4 2337 B10R1.25 CSc1ccc(cc1N)F 62a_100000687223_200000210301 [1,1,0,0,0,0|2,0,0]=4 2338 B10R1.25 CSc1ccc(cc1N)F 62a_200000210301_100000687223 [1,1,0,0,0,0|2,0,0]=4 2339 B10R1.25 CSc1ccc(cc1N)N 62a_200000210301_200012175722 [1,1,0,0,0,0|2,0,0]=4 2340 B10R1.25 CSc1ccc(cc1N)N 62a_200012175722_200000210301 [1,1,0,0,0,0|2,0,0]=4 2341 B10R1.25 CSc1ccc(cc1N)O 62a_100011999798_200000210301 [1,1,0,0,0,0|2,0,0]=4 2342 B10R1.25 CSc1ccc(cc1N)O 62a_200000210301_100011999798 [1,1,0,0,0,0|2,0,0]=4 2343 B10R1.25 CSc1ccc(cc1O)Br 62a_100012344904_200000210301 [1,1,0,0,0,0|2,0,0]=4 2344 B10R1.25 CSc1ccc(cc1O)Br 62a_200000210301_100012344904 [1,1,0,0,0,0|2,0,0]=4 2345 B10R1.25 CSc1ccc(cc1O)C 271570a_203496583355_200010201864 [1,1,0,0,0,0|1,0,0]=3 2346 B10R1.25 CSc1ccc(cc1O)C 62a_100012002257_200000210301 [1,1,0,0,0,0|1,0,0]=3 2347 B10R1.25 CSc1ccc(cc1O)C 62a_200000210301_100012002257 [1,1,0,0,0,0|1,0,0]=3 2348 B10R1.25 CSc1ccc(cc1O)Cl 62a_100000050036_200000210301 [1,1,0,0,0,0|2,0,0]=4 2349 B10R1.25 CSc1ccc(cc1O)Cl 62a_200000210301_100000050036 [1,1,0,0,0,0|2,0,0]=4 2350 B10R1.25 CSc1ccc(cc1O)F 271570a_203496583355_100009817003 [1,1,0,0,0,0|2,0,0]=4 2351 B10R1.25 CSc1ccc(cc1O)F 62a_100000690578_200000210301 [1,1,0,0,0,0|2,0,0]=4 2352 B10R1.25 CSc1ccc(cc1O)F 62a_200000210301_100000690578 [1,1,0,0,0,0|2,0,0]=4 2353 B10R1.25 CSc1ccc(cc1O)O 62a_200000210301_100009813921 [1,1,0,0,0,0|2,0,0]=4 2354 B10R1.25 CSc1ccc(nc1C)C 62a_100009813853_200000210301 [1,1,0,0,0,0|2,0,0]=4 2355 B10R1.25 CSc1ccc(nc1C)C 62a_200000210301_100009813853 [1,1,0,0,0,0|2,0,0]=4 2356 B10R1.25 CSc1ccc(nc1F)C 62a_100010006597_200000210301 [1,1,0,0,0,0|2,0,0]=4 2357 B10R1.25 CSc1ccc(nc1F)C 62a_200000210301_100010006597 [1,1,0,0,0,0|2,0,0]=4 2358 B10R1.25 CSc1ccc(nc1N)C 62a_100009816662_200000210301 [1,1,0,0,0,0|2,0,0]=4 2359 B10R1.25 CSc1ccc(nc1N)C 62a_200000210301_100009816662 [1,1,0,0,0,0|2,0,0]=4 2360 B10R1.25 CSc1ccc(nc1O)C 62a_100009817604_200000210301 [1,1,0,0,0,0|2,0,0]=4 2361 B10R1.25 CSc1ccc(nc1O)C 62a_200000210301_100009817604 [1,1,0,0,0,0|2,0,0]=4 2362 B10R1.25 CSc1cnc(cc1C)C 62a_100009819613_200000210301 [1,1,0,0,0,0|2,0,0]=4 2363 B10R1.25 CSc1cnc(cc1C)C 62a_200000210301_100009819613 [1,1,0,0,0,0|2,0,0]=4 2364 B10R1.25 CSc1cnc(cc1N)C 62a_100009817891_200000210301 [1,1,0,0,0,0|2,0,0]=4 2365 B10R1.25 CSc1cnc(cc1N)C 62a_200000210301_100009817891 [1,1,0,0,0,0|2,0,0]=4 2366 B10R1.25 CSc1cnc(cc1O)C 62a_100011016184_200000210301 [1,1,0,0,0,0|2,0,0]=4 2367 B10R1.25 CSc1cnc(cc1O)C 62a_200000210301_100011016184 [1,1,0,0,0,0|2,0,0]=4 2368 B10R1.25 CSc1ncc(cc1C)C 62a_100009864548_200000210301 [1,1,0,0,0,0|2,0,0]=4 2369 B10R1.25 CSc1ncc(cc1C)C 62a_200000210301_100009864548 [1,1,0,0,0,0|2,0,0]=4 2370 B10R1.25 CSc1ncc(cc1F)C 62a_100009819633_200000210301 [1,1,0,0,0,0|2,0,0]=4 2371 B10R1.25 CSc1ncc(cc1F)C 62a_200000210301_100009819633 [1,1,0,0,0,0|2,0,0]=4 2372 B10R1.25 CSc1ncc(cc1N)C 62a_100000733613_200000210301 [1,1,0,0,0,0|2,0,0]=4 2373 B10R1.25 CSc1ncc(cc1N)C 62a_200000210301_100000733613 [1,1,0,0,0,0|2,0,0]=4 2374 B10R1.25 CSc1ncc(cc1O)C 62a_200000210301_100012000487 [1,1,0,0,0,0|2,0,0]=4 2375 B10R1.25 Cc1cc(=O)c(co1)O[13CH3] 34a_100000081520_200025704644 [1,1,0,0,0,0|2,0,0]=4 2376 B10R1.25 Cc1cc(c(cn1)O[13CH3])Br 34a_100009843476_200025704644 [1,1,0,0,0,0|2,0,0]=4 2377 B10R1.25 Cc1cc(c(cn1)O[13CH3])Br 7a_100009843476_200025704644 [1,1,0,0,0,0|2,0,0]=4 2378 B10R1.25 Cc1cc(c(cn1)O[13CH3])C 34a_200000068632_200025704644 [1,1,0,0,0,0|2,0,0]=4 2379 B10R1.25 Cc1cc(c(cn1)O[13CH3])C 7a_200000068632_200025704644 [1,1,0,0,0,0|2,0,0]=4 2380 B10R1.25 Cc1cc(c(cn1)S[13CH3])C 62a_100009819613_200025704644 [1,1,0,0,0,0|2,0,0]=4 2381 B10R1.25 Cc1cc(c(cn1)S[13CH3])C 62a_200025704644_100009819613 [1,1,0,0,0,0|2,0,0]=4 2382 B10R1.25 Cc1cc(c(cn1)S[13CH3])N 62a_100009817891_200025704644 [1,1,0,0,0,0|2,0,0]=4 2383 B10R1.25 Cc1cc(c(cn1)S[13CH3])N 62a_200025704644_100009817891 [1,1,0,0,0,0|2,0,0]=4 2384 B10R1.25 Cc1cc(c(cn1)S[13CH3])O 62a_100011016184_200025704644 [1,1,0,0,0,0|2,0,0]=4 2385 B10R1.25 Cc1cc(c(cn1)S[13CH3])O 62a_200025704644_100011016184 [1,1,0,0,0,0|2,0,0]=4 2386 B10R1.25 Cc1cc(ccc1C=O)O 271570a_203496583355_100000687586 [1,1,0,0,0,0|1,0,0]=3 2387 B10R1.25 Cc1cc(ccc1N[13CH3])Br 34a_100000211769_200025704644 [1,1,0,0,0,0|2,0,0]=4 2388 B10R1.25 Cc1cc(ccc1N[13CH3])Br 7a_100000211769_200025704644 [1,1,0,0,0,0|2,0,0]=4 2389 B10R1.25 Cc1cc(ccc1N[13CH3])Cl 34a_100000210418_200025704644 [1,1,0,0,0,0|2,0,0]=4 2390 B10R1.25 Cc1cc(ccc1N[13CH3])Cl 7a_100000210418_200025704644 [1,1,0,0,0,0|2,0,0]=4 2391 B10R1.25 Cc1cc(ccc1N[13CH3])F 34a_100000211637_200025704644 [1,1,0,0,0,0|2,0,0]=4 2392 B10R1.25 Cc1cc(ccc1N[13CH3])F 7a_100000211637_200025704644 [1,1,0,0,0,0|2,0,0]=4 2393 B10R1.25 Cc1cc(ccc1N[13CH3])I 34a_100000184554_200025704644 [1,1,0,0,0,0|2,0,0]=4 2394 B10R1.25 Cc1cc(ccc1N[13CH3])I 7a_100000184554_200025704644 [1,1,0,0,0,0|2,0,0]=4 2395 B10R1.25 Cc1cc(ccc1N[13CH3])O 34a_100000756630_200025704644 [1,1,0,0,0,0|2,0,0]=4 2396 B10R1.25 Cc1cc(ccc1O[13CH3])Br 34a_100000186361_200025704644 [1,1,0,0,0,0|2,0,0]=4 2397 B10R1.25 Cc1cc(ccc1O[13CH3])Br 7a_100000186361_200025704644 [1,1,0,0,0,0|2,0,0]=4 2398 B10R1.25 Cc1cc(ccc1O[13CH3])Cl 34a_100000211091_200025704644 [1,1,0,0,0,0|2,0,0]=4 2399 B10R1.25 Cc1cc(ccc1O[13CH3])Cl 7a_100000211091_200025704644 [1,1,0,0,0,0|2,0,0]=4 2400 B10R1.25 Cc1cc(ccc1O[13CH3])F 34a_100000764316_200025704644 [1,1,0,0,0,0|2,0,0]=4 2401 B10R1.25 Cc1cc(ccc1O[13CH3])F 7a_100000764316_200025704644 [1,1,0,0,0,0|2,0,0]=4 2402 B10R1.25 Cc1cc(ccc1O[13CH3])I 34a_100011218673_200025704644 [1,1,0,0,0,0|2,0,0]=4 2403 B10R1.25 Cc1cc(ccc1O[13CH3])I 7a_100011218673_200025704644 [1,1,0,0,0,0|2,0,0]=4 2404 B10R1.25 Cc1cc(ccc1O[13CH3])N 34a_100011218179_200025704644 [1,1,0,0,0,0|2,0,0]=4 2405 B10R1.25 Cc1cc(ccc1O[13CH3])N 7a_100011218179_200025704644 [1,1,0,0,0,0|2,0,0]=4 2406 B10R1.25 Cc1cc(ccc1S[13CH3])Br 62a_100000701812_200025704644 [1,1,0,0,0,0|2,0,0]=4 2407 B10R1.25 Cc1cc(ccc1S[13CH3])Br 62a_200025704644_100000701812 [1,1,0,0,0,0|2,0,0]=4 2408 B10R1.25 Cc1cc(ccc1S[13CH3])Cl 62a_100011219607_200025704644 [1,1,0,0,0,0|2,0,0]=4 2409 B10R1.25 Cc1cc(ccc1S[13CH3])Cl 62a_200025704644_100011219607 [1,1,0,0,0,0|2,0,0]=4 2410 B10R1.25 Cc1cc(ccc1S[13CH3])F 62a_100011205405_200025704644 [1,1,0,0,0,0|2,0,0]=4 2411 B10R1.25 Cc1cc(ccc1S[13CH3])F 62a_200025704644_100011205405 [1,1,0,0,0,0|2,0,0]=4 2412 B10R1.25 Cc1cc(ccc1S[13CH3])N 62a_100000210723_200025704644 [1,1,0,0,0,0|2,0,0]=4 2413 B10R1.25 Cc1cc(ccc1S[13CH3])N 62a_200025704644_100000210723 [1,1,0,0,0,0|2,0,0]=4 2414 B10R1.25 Cc1cc(ccc1S[13CH3])O 62a_200025704644_100000690111 [1,1,0,0,0,0|2,0,0]=4 2415 B10R1.25 Cc1cc(cnc1C=O)O 271570a_203496583355_100010185443 [1,1,0,0,0,0|2,0,0]=4 2416 B10R1.25 Cc1cc(ncc1C=O)O 271570a_203496583355_100000085382 [1,1,0,0,0,0|2,0,0]=4 2417 B10R1.25 Cc1ccc([n+](c1)[O-])S[13CH3] 62a_200025704644_100009819918 [1,1,0,0,0,0|2,0,0]=4 2418 B10R1.25 Cc1ccc(c(c1)Br)N[13CH3] 34a_100000210942_200025704644 [1,1,0,0,0,0|1,0,0]=3 2419 B10R1.25 Cc1ccc(c(c1)Br)O[13CH3] 34a_100000210800_200025704644 [1,1,0,0,0,0|1,0,0]=3 2420 B10R1.25 Cc1ccc(c(c1)Br)O[13CH3] 7a_100000210800_200025704644 [1,1,0,0,0,0|1,0,0]=3 2421 B10R1.25 Cc1ccc(c(c1)Br)S[13CH3] 62a_100009813563_200025704644 [1,1,0,0,0,0|1,0,0]=3 2422 B10R1.25 Cc1ccc(c(c1)Br)S[13CH3] 62a_200025704644_100009813563 [1,1,0,0,0,0|1,0,0]=3 2423 B10R1.25 Cc1ccc(c(c1)C)N[13CH3] 34a_100000736561_200025704644 [1,1,0,0,0,0|1,0,0]=3 2424 B10R1.25 Cc1ccc(c(c1)C)N[13CH3] 7a_100000736561_200025704644 [1,1,0,0,0,0|1,0,0]=3 2425 B10R1.25 Cc1ccc(c(c1)C)O[13CH3] 34a_100000211776_200025704644 [1,1,0,0,0,0|1,0,0]=3 2426 B10R1.25 Cc1ccc(c(c1)C)O[13CH3] 7a_100000211776_200025704644 [1,1,0,0,0,0|1,0,0]=3 2427 B10R1.25 Cc1ccc(c(c1)C)S[13CH3] 62a_100011217332_200025704644 [1,1,0,0,0,0|1,0,0]=3 2428 B10R1.25 Cc1ccc(c(c1)C)S[13CH3] 62a_200025704644_100011217332 [1,1,0,0,0,0|1,0,0]=3 2429 B10R1.25 Cc1ccc(c(c1)Cl)N[13CH3] 34a_100000210522_200025704644 [1,1,0,0,0,0|1,0,0]=3 2430 B10R1.25 Cc1ccc(c(c1)Cl)O[13CH3] 34a_100000749699_200025704644 [1,1,0,0,0,0|1,0,0]=3 2431 B10R1.25 Cc1ccc(c(c1)Cl)O[13CH3] 7a_100000749699_200025704644 [1,1,0,0,0,0|1,0,0]=3 2432 B10R1.25 Cc1ccc(c(c1)Cl)S[13CH3] 62a_100011263221_200025704644 [1,1,0,0,0,0|1,0,0]=3 2433 B10R1.25 Cc1ccc(c(c1)Cl)S[13CH3] 62a_200025704644_100011263221 [1,1,0,0,0,0|1,0,0]=3 2434 B10R1.25 Cc1ccc(c(c1)F)N[13CH3] 34a_100000211023_200025704644 [1,1,0,0,0,0|1,0,0]=3 2435 B10R1.25 Cc1ccc(c(c1)F)O[13CH3] 34a_100011216688_200025704644 [1,1,0,0,0,0|1,0,0]=3 2436 B10R1.25 Cc1ccc(c(c1)F)O[13CH3] 7a_100011216688_200025704644 [1,1,0,0,0,0|1,0,0]=3 2437 B10R1.25 Cc1ccc(c(c1)F)S[13CH3] 62a_100011216119_200025704644 [1,1,0,0,0,0|1,0,0]=3 2438 B10R1.25 Cc1ccc(c(c1)F)S[13CH3] 62a_200025704644_100011216119 [1,1,0,0,0,0|1,0,0]=3 2439 B10R1.25 Cc1ccc(c(c1)I)N[13CH3] 34a_100011356834_200025704644 [1,1,0,0,0,0|1,0,0]=3 2440 B10R1.25 Cc1ccc(c(c1)I)O[13CH3] 34a_100000765521_200025704644 [1,1,0,0,0,0|1,0,0]=3 2441 B10R1.25 Cc1ccc(c(c1)I)O[13CH3] 7a_100000765521_200025704644 [1,1,0,0,0,0|1,0,0]=3 2442 B10R1.25 Cc1ccc(c(c1)N)O[13CH3] 34a_100011215204_200025704644 [1,1,0,0,0,0|1,0,0]=3 2443 B10R1.25 Cc1ccc(c(c1)N)O[13CH3] 7a_100011215204_200025704644 [1,1,0,0,0,0|1,0,0]=3 2444 B10R1.25 Cc1ccc(c(c1)N)S[13CH3] 62a_100011216686_200025704644 [1,1,0,0,0,0|1,0,0]=3 2445 B10R1.25 Cc1ccc(c(c1)N)S[13CH3] 62a_200025704644_100011216686 [1,1,0,0,0,0|1,0,0]=3 2446 B10R1.25 Cc1ccc(c(c1)O)C#N 271570a_203496583355_100000693804 [1,1,0,0,0,0|1,0,1]=4 2447 B10R1.25 Cc1ccc(c(c1)O)C=O 271570a_203496583355_100000692596 [1,1,0,0,0,0|0,0,0]=2 2448 B10R1.25 Cc1ccc(c(c1)O)NN 271570a_203496583355_100016996181 [1,1,0,0,0,0|2,0,0]=4 2449 B10R1.25 Cc1ccc(c(c1)O)N[13CH3] 34a_100000211527_200025704644 [1,1,0,0,0,0|1,0,0]=3 2450 B10R1.25 Cc1ccc(c(c1)O)S[13CH3] 62a_100012002257_200025704644 [1,1,0,0,0,0|1,0,0]=3 2451 B10R1.25 Cc1ccc(c(c1)O)S[13CH3] 62a_200025704644_100012002257 [1,1,0,0,0,0|1,0,0]=3 2452 B10R1.25 Cc1ccc(c(n1)Br)O[13CH3] 34a_100000702858_200025704644 [1,1,0,0,0,0|2,0,0]=4 2453 B10R1.25 Cc1ccc(c(n1)Br)O[13CH3] 7a_100000702858_200025704644 [1,1,0,0,0,0|2,0,0]=4 2454 B10R1.25 Cc1ccc(c(n1)C)O[13CH3] 34a_100011218912_200025704644 [1,1,0,0,0,0|2,0,0]=4 2455 B10R1.25 Cc1ccc(c(n1)C)O[13CH3] 7a_100011218912_200025704644 [1,1,0,0,0,0|2,0,0]=4 2456 B10R1.25 Cc1ccc(c(n1)C)S[13CH3] 62a_100009813853_200025704644 [1,1,0,0,0,0|2,0,0]=4 2457 B10R1.25 Cc1ccc(c(n1)C)S[13CH3] 62a_200025704644_100009813853 [1,1,0,0,0,0|2,0,0]=4 2458 B10R1.25 Cc1ccc(c(n1)Cl)O[13CH3] 34a_100000086286_200025704644 [1,1,0,0,0,0|2,0,0]=4 2459 B10R1.25 Cc1ccc(c(n1)Cl)O[13CH3] 7a_100000086286_200025704644 [1,1,0,0,0,0|2,0,0]=4 2460 B10R1.25 Cc1ccc(c(n1)F)O[13CH3] 34a_100000079963_200025704644 [1,1,0,0,0,0|2,0,0]=4 2461 B10R1.25 Cc1ccc(c(n1)F)O[13CH3] 7a_100000079963_200025704644 [1,1,0,0,0,0|2,0,0]=4 2462 B10R1.25 Cc1ccc(c(n1)F)S[13CH3] 62a_100010006597_200025704644 [1,1,0,0,0,0|2,0,0]=4 2463 B10R1.25 Cc1ccc(c(n1)F)S[13CH3] 62a_200025704644_100010006597 [1,1,0,0,0,0|2,0,0]=4 2464 B10R1.25 Cc1ccc(c(n1)I)O[13CH3] 34a_100000023897_200025704644 [1,1,0,0,0,0|2,0,0]=4 2465 B10R1.25 Cc1ccc(c(n1)I)O[13CH3] 7a_100000023897_200025704644 [1,1,0,0,0,0|2,0,0]=4 2466 B10R1.25 Cc1ccc(c(n1)N)O[13CH3] 34a_100000694039_200025704644 [1,1,0,0,0,0|2,0,0]=4 2467 B10R1.25 Cc1ccc(c(n1)N)O[13CH3] 7a_100000694039_200025704644 [1,1,0,0,0,0|2,0,0]=4 2468 B10R1.25 Cc1ccc(c(n1)N)S[13CH3] 62a_100009816662_200025704644 [1,1,0,0,0,0|2,0,0]=4 2469 B10R1.25 Cc1ccc(c(n1)N)S[13CH3] 62a_200025704644_100009816662 [1,1,0,0,0,0|2,0,0]=4 2470 B10R1.25 Cc1ccc(c(n1)O)C=O 271570a_203496583355_100000085379 [1,1,0,0,0,0|1,0,0]=3 2471 B10R1.25 Cc1ccc(c(n1)O)S[13CH3] 62a_100009817604_200025704644 [1,1,0,0,0,0|2,0,0]=4 2472 B10R1.25 Cc1ccc(c(n1)O)S[13CH3] 62a_200025704644_100009817604 [1,1,0,0,0,0|2,0,0]=4 2473 B10R1.25 Cc1cnc(c(c1)Br)O[13CH3] 34a_100000719714_200025704644 [1,1,0,0,0,0|2,0,0]=4 2474 B10R1.25 Cc1cnc(c(c1)C)S[13CH3] 62a_100009864548_200025704644 [1,1,0,0,0,0|2,0,0]=4 2475 B10R1.25 Cc1cnc(c(c1)C)S[13CH3] 62a_200025704644_100009864548 [1,1,0,0,0,0|2,0,0]=4 2476 B10R1.25 Cc1cnc(c(c1)F)S[13CH3] 62a_100009819633_200025704644 [1,1,0,0,0,0|2,0,0]=4 2477 B10R1.25 Cc1cnc(c(c1)F)S[13CH3] 62a_200025704644_100009819633 [1,1,0,0,0,0|2,0,0]=4 2478 B10R1.25 Cc1cnc(c(c1)N)O[13CH3] 34a_100012000488_200025704644 [1,1,0,0,0,0|2,0,0]=4 2479 B10R1.25 Cc1cnc(c(c1)N)S[13CH3] 62a_100000733613_200025704644 [1,1,0,0,0,0|2,0,0]=4 2480 B10R1.25 Cc1cnc(c(c1)N)S[13CH3] 62a_200025704644_100000733613 [1,1,0,0,0,0|2,0,0]=4 2481 B10R1.25 Cc1cnc(c(c1)O)S[13CH3] 62a_200025704644_100012000487 [1,1,0,0,0,0|2,0,0]=4 2482 B10R1.25 Cc1nc(ccc1C=O)O 271570a_203496583355_100000050599 [1,1,0,0,0,0|2,0,0]=4 2483 B10R1.25 Nc1cc(ccc1C=O)O 271570a_203496583355_100009814810 [1,1,0,0,0,0|1,0,0]=3 2484 B10R1.25 O=Cc1ccc(cc1Br)O 271570a_203496583355_100010185650 [1,1,0,0,0,0|1,0,0]=3 2485 B10R1.25 O=Cc1ccc(cc1Cl)O 271570a_203496583355_100000727542 [1,1,0,0,0,0|1,0,0]=3 2486 B10R1.25 O=Cc1ccc(cc1F)O 271570a_203496583355_100000211676 [1,1,0,0,0,0|1,0,0]=3 2487 B10R1.25 O=Cc1ccc(cc1O)Br 271570a_203496583355_100010146562 [1,1,0,0,0,0|1,0,0]=3 2488 B10R1.25 O=Cc1ccc(cc1O)F 271570a_203496583355_100000752949 [1,1,0,0,0,0|1,0,0]=3 2489 B10R1.25 O=Cc1ccc(cc1O)O 271570a_203496583355_100011236494 [1,1,0,0,0,0|1,0,0]=3 2490 B10R1.25 O=Cc1ccc(cc1O)O 271570a_203496583355_100011277552 [1,1,0,0,0,0|1,0,0]=3 2491 B10R1.25 O=Cc1ccc(nc1F)O 271570a_203496583355_100010064369 [1,1,0,0,0,0|2,0,0]=4 2492 B10R1.25 O=Cc1ccc(nc1O)F 271570a_203496583355_100009846357 [1,1,0,0,0,0|2,0,0]=4 2493 B10R1.25 O=Cc1cnc(cc1O)F 271570a_203496583355_100009862493 [1,1,0,0,0,0|2,0,0]=4 2494 B10R1.25 O=Cc1ncc(cc1F)O 271570a_203496583355_100010180630 [1,1,0,0,0,0|2,0,0]=4 2495 B10R1.25 [13CH3]Nc1ccc(cc1Br)Br 34a_100000211012_200025704644 [1,1,0,0,0,0|2,0,0]=4 2496 B10R1.25 [13CH3]Nc1ccc(cc1Br)Cl 34a_100000752454_200025704644 [1,1,0,0,0,0|2,0,0]=4 2497 B10R1.25 [13CH3]Nc1ccc(cc1Br)F 34a_100000738039_200025704644 [1,1,0,0,0,0|2,0,0]=4 2498 B10R1.25 [13CH3]Nc1ccc(cc1Br)O 34a_100012001276_200025704644 [1,1,0,0,0,0|2,0,0]=4 2499 B10R1.25 [13CH3]Nc1ccc(cc1Cl)Br 34a_100000211467_200025704644 [1,1,0,0,0,0|2,0,0]=4 2500 B10R1.25 [13CH3]Nc1ccc(cc1Cl)Cl 34a_100000185861_200025704644 [1,1,0,0,0,0|2,0,0]=4 2501 B10R1.25 [13CH3]Nc1ccc(cc1Cl)F 34a_100000212003_200025704644 [1,1,0,0,0,0|2,0,0]=4 2502 B10R1.25 [13CH3]Nc1ccc(cc1Cl)I 34a_100011218065_200025704644 [1,1,0,0,0,0|2,0,0]=4 2503 B10R1.25 [13CH3]Nc1ccc(cc1Cl)O 34a_100011215599_200025704644 [1,1,0,0,0,0|2,0,0]=4 2504 B10R1.25 [13CH3]Nc1ccc(cc1F)Br 34a_100000210722_200025704644 [1,1,0,0,0,0|2,0,0]=4 2505 B10R1.25 [13CH3]Nc1ccc(cc1F)Cl 34a_100000211020_200025704644 [1,1,0,0,0,0|2,0,0]=4 2506 B10R1.25 [13CH3]Nc1ccc(cc1F)F 34a_100000210720_200025704644 [1,1,0,0,0,0|2,0,0]=4 2507 B10R1.25 [13CH3]Nc1ccc(cc1F)I 34a_100011215594_200025704644 [1,1,0,0,0,0|2,0,0]=4 2508 B10R1.25 [13CH3]Nc1ccc(cc1F)O 34a_100000759473_200025704644 [1,1,0,0,0,0|2,0,0]=4 2509 B10R1.25 [13CH3]Nc1ccc(cc1I)Br 34a_100000187925_200025704644 [1,1,0,0,0,0|2,0,0]=4 2510 B10R1.25 [13CH3]Nc1ccc(cc1I)Cl 34a_100000761889_200025704644 [1,1,0,0,0,0|2,0,0]=4 2511 B10R1.25 [13CH3]Nc1ccc(cc1I)F 34a_100000760547_200025704644 [1,1,0,0,0,0|2,0,0]=4 2512 B10R1.25 [13CH3]Nc1ccc(cc1I)O 34a_100010084370_200025704644 [1,1,0,0,0,0|2,0,0]=4 2513 B10R1.25 [13CH3]Nc1ccc(cc1O)Br 34a_100000739049_200025704644 [1,1,0,0,0,0|2,0,0]=4 2514 B10R1.25 [13CH3]Nc1ccc(cc1O)Cl 34a_100000185728_200025704644 [1,1,0,0,0,0|2,0,0]=4 2515 B10R1.25 [13CH3]Nc1ccc(cc1O)F 34a_100000753323_200025704644 [1,1,0,0,0,0|2,0,0]=4 2516 B10R1.25 [13CH3]Nc1ccc(cc1O)O 34a_100000106777_200025704644 [1,1,0,0,0,0|2,0,0]=4 2517 B10R1.25 [13CH3]Oc1ccc(cc1Br)Br 34a_100000188717_200025704644 [1,1,0,0,0,0|2,0,0]=4 2518 B10R1.25 [13CH3]Oc1ccc(cc1Br)Br 7a_100000188717_200025704644 [1,1,0,0,0,0|2,0,0]=4 2519 B10R1.25 [13CH3]Oc1ccc(cc1Br)Cl 34a_100000211998_200025704644 [1,1,0,0,0,0|2,0,0]=4 2520 B10R1.25 [13CH3]Oc1ccc(cc1Br)Cl 7a_100000211998_200025704644 [1,1,0,0,0,0|2,0,0]=4 2521 B10R1.25 [13CH3]Oc1ccc(cc1Br)F 34a_100000211999_200025704644 [1,1,0,0,0,0|2,0,0]=4 2522 B10R1.25 [13CH3]Oc1ccc(cc1Br)F 7a_100000211999_200025704644 [1,1,0,0,0,0|2,0,0]=4 2523 B10R1.25 [13CH3]Oc1ccc(cc1Br)I 34a_100012361655_200025704644 [1,1,0,0,0,0|2,0,0]=4 2524 B10R1.25 [13CH3]Oc1ccc(cc1Br)I 7a_100012361655_200025704644 [1,1,0,0,0,0|2,0,0]=4 2525 B10R1.25 [13CH3]Oc1ccc(cc1Br)N 34a_100011534360_200025704644 [1,1,0,0,0,0|2,0,0]=4 2526 B10R1.25 [13CH3]Oc1ccc(cc1Br)N 7a_100011534360_200025704644 [1,1,0,0,0,0|2,0,0]=4 2527 B10R1.25 [13CH3]Oc1ccc(cc1Cl)Br 34a_100000186472_200025704644 [1,1,0,0,0,0|2,0,0]=4 2528 B10R1.25 [13CH3]Oc1ccc(cc1Cl)Br 7a_100000186472_200025704644 [1,1,0,0,0,0|2,0,0]=4 2529 B10R1.25 [13CH3]Oc1ccc(cc1Cl)Cl 34a_100015191787_200025704644 [1,1,0,0,0,0|2,0,0]=4 2530 B10R1.25 [13CH3]Oc1ccc(cc1Cl)Cl 7a_100015191787_200025704644 [1,1,0,0,0,0|2,0,0]=4 2531 B10R1.25 [13CH3]Oc1ccc(cc1Cl)F 34a_100000212004_200025704644 [1,1,0,0,0,0|2,0,0]=4 2532 B10R1.25 [13CH3]Oc1ccc(cc1Cl)F 7a_100000212004_200025704644 [1,1,0,0,0,0|2,0,0]=4 2533 B10R1.25 [13CH3]Oc1ccc(cc1Cl)I 34a_100012360047_200025704644 [1,1,0,0,0,0|2,0,0]=4 2534 B10R1.25 [13CH3]Oc1ccc(cc1Cl)I 7a_100012360047_200025704644 [1,1,0,0,0,0|2,0,0]=4 2535 B10R1.25 [13CH3]Oc1ccc(cc1Cl)N 34a_100000744943_200025704644 [1,1,0,0,0,0|2,0,0]=4 2536 B10R1.25 [13CH3]Oc1ccc(cc1Cl)N 7a_100000744943_200025704644 [1,1,0,0,0,0|2,0,0]=4 2537 B10R1.25 [13CH3]Oc1ccc(cc1F)Br 34a_100000185481_200025704644 [1,1,0,0,0,0|2,0,0]=4 2538 B10R1.25 [13CH3]Oc1ccc(cc1F)Br 7a_100000185481_200025704644 [1,1,0,0,0,0|2,0,0]=4 2539 B10R1.25 [13CH3]Oc1ccc(cc1F)Cl 34a_100000230166_200025704644 [1,1,0,0,0,0|2,0,0]=4 2540 B10R1.25 [13CH3]Oc1ccc(cc1F)Cl 7a_100000230166_200025704644 [1,1,0,0,0,0|2,0,0]=4 2541 B10R1.25 [13CH3]Oc1ccc(cc1F)F 34a_100000230127_200025704644 [1,1,0,0,0,0|2,0,0]=4 2542 B10R1.25 [13CH3]Oc1ccc(cc1F)F 7a_100000230127_200025704644 [1,1,0,0,0,0|2,0,0]=4 2543 B10R1.25 [13CH3]Oc1ccc(cc1F)I 34a_100011356965_200025704644 [1,1,0,0,0,0|2,0,0]=4 2544 B10R1.25 [13CH3]Oc1ccc(cc1F)I 7a_100011356965_200025704644 [1,1,0,0,0,0|2,0,0]=4 2545 B10R1.25 [13CH3]Oc1ccc(cc1F)N 34a_100011220035_200025704644 [1,1,0,0,0,0|2,0,0]=4 2546 B10R1.25 [13CH3]Oc1ccc(cc1F)N 7a_100011220035_200025704644 [1,1,0,0,0,0|2,0,0]=4 2547 B10R1.25 [13CH3]Oc1ccc(cc1I)Br 34a_100012355227_200025704644 [1,1,0,0,0,0|2,0,0]=4 2548 B10R1.25 [13CH3]Oc1ccc(cc1I)Br 7a_100012355227_200025704644 [1,1,0,0,0,0|2,0,0]=4 2549 B10R1.25 [13CH3]Oc1ccc(cc1I)Cl 34a_100011356953_200025704644 [1,1,0,0,0,0|2,0,0]=4 2550 B10R1.25 [13CH3]Oc1ccc(cc1I)Cl 7a_100011356953_200025704644 [1,1,0,0,0,0|2,0,0]=4 2551 B10R1.25 [13CH3]Oc1ccc(cc1I)F 34a_100012355409_200025704644 [1,1,0,0,0,0|2,0,0]=4 2552 B10R1.25 [13CH3]Oc1ccc(cc1I)F 7a_100012355409_200025704644 [1,1,0,0,0,0|2,0,0]=4 2553 B10R1.25 [13CH3]Oc1ccc(cc1I)I 7a_100010001573_200025704644 [1,1,0,0,0,0|2,0,0]=4 2554 B10R1.25 [13CH3]Oc1ccc(cc1N)Br 34a_100000752626_200025704644 [1,1,0,0,0,0|2,0,0]=4 2555 B10R1.25 [13CH3]Oc1ccc(cc1N)Br 7a_100000752626_200025704644 [1,1,0,0,0,0|2,0,0]=4 2556 B10R1.25 [13CH3]Oc1ccc(cc1N)Cl 34a_100000210500_200025704644 [1,1,0,0,0,0|2,0,0]=4 2557 B10R1.25 [13CH3]Oc1ccc(cc1N)Cl 7a_100000210500_200025704644 [1,1,0,0,0,0|2,0,0]=4 2558 B10R1.25 [13CH3]Oc1ccc(cc1N)F 34a_100000759472_200025704644 [1,1,0,0,0,0|2,0,0]=4 2559 B10R1.25 [13CH3]Oc1ccc(cc1N)F 7a_100000759472_200025704644 [1,1,0,0,0,0|2,0,0]=4 2560 B10R1.25 [13CH3]Oc1ccc(cc1N)I 34a_100000753495_200025704644 [1,1,0,0,0,0|2,0,0]=4 2561 B10R1.25 [13CH3]Oc1ccc(cc1N)I 7a_100000753495_200025704644 [1,1,0,0,0,0|2,0,0]=4 2562 B10R1.25 [13CH3]Oc1ccc(cc1N)N 34a_100000725306_200025704644 [1,1,0,0,0,0|2,0,0]=4 2563 B10R1.25 [13CH3]Sc1ccc(cc1Br)Br 62a_100011484698_200025704644 [1,1,0,0,0,0|2,0,0]=4 2564 B10R1.25 [13CH3]Sc1ccc(cc1Br)Br 62a_200025704644_100011484698 [1,1,0,0,0,0|2,0,0]=4 2565 B10R1.25 [13CH3]Sc1ccc(cc1Br)Cl 62a_100011219703_200025704644 [1,1,0,0,0,0|2,0,0]=4 2566 B10R1.25 [13CH3]Sc1ccc(cc1Br)Cl 62a_200025704644_100011219703 [1,1,0,0,0,0|2,0,0]=4 2567 B10R1.25 [13CH3]Sc1ccc(cc1Br)F 62a_100011217111_200025704644 [1,1,0,0,0,0|2,0,0]=4 2568 B10R1.25 [13CH3]Sc1ccc(cc1Br)F 62a_200025704644_100011217111 [1,1,0,0,0,0|2,0,0]=4 2569 B10R1.25 [13CH3]Sc1ccc(cc1Br)N 62a_100000750458_200025704644 [1,1,0,0,0,0|2,0,0]=4 2570 B10R1.25 [13CH3]Sc1ccc(cc1Br)N 62a_200025704644_100000750458 [1,1,0,0,0,0|2,0,0]=4 2571 B10R1.25 [13CH3]Sc1ccc(cc1Br)O 62a_100000701344_200025704644 [1,1,0,0,0,0|2,0,0]=4 2572 B10R1.25 [13CH3]Sc1ccc(cc1Br)O 62a_200025704644_100000701344 [1,1,0,0,0,0|2,0,0]=4 2573 B10R1.25 [13CH3]Sc1ccc(cc1Cl)Br 62a_100011216062_200025704644 [1,1,0,0,0,0|2,0,0]=4 2574 B10R1.25 [13CH3]Sc1ccc(cc1Cl)Br 62a_200025704644_100011216062 [1,1,0,0,0,0|2,0,0]=4 2575 B10R1.25 [13CH3]Sc1ccc(cc1Cl)Cl 62a_100000699841_200025704644 [1,1,0,0,0,0|2,0,0]=4 2576 B10R1.25 [13CH3]Sc1ccc(cc1Cl)Cl 62a_200025704644_100000699841 [1,1,0,0,0,0|2,0,0]=4 2577 B10R1.25 [13CH3]Sc1ccc(cc1Cl)F 62a_100000733362_200025704644 [1,1,0,0,0,0|2,0,0]=4 2578 B10R1.25 [13CH3]Sc1ccc(cc1Cl)F 62a_200025704644_100000733362 [1,1,0,0,0,0|2,0,0]=4 2579 B10R1.25 [13CH3]Sc1ccc(cc1Cl)N 62a_100000761885_200025704644 [1,1,0,0,0,0|2,0,0]=4 2580 B10R1.25 [13CH3]Sc1ccc(cc1Cl)N 62a_200025704644_100000761885 [1,1,0,0,0,0|2,0,0]=4 2581 B10R1.25 [13CH3]Sc1ccc(cc1Cl)O 62a_100000047559_200025704644 [1,1,0,0,0,0|2,0,0]=4 2582 B10R1.25 [13CH3]Sc1ccc(cc1Cl)O 62a_200025704644_100000047559 [1,1,0,0,0,0|2,0,0]=4 2583 B10R1.25 [13CH3]Sc1ccc(cc1F)Br 62a_100009814013_200025704644 [1,1,0,0,0,0|2,0,0]=4 2584 B10R1.25 [13CH3]Sc1ccc(cc1F)Br 62a_200025704644_100009814013 [1,1,0,0,0,0|2,0,0]=4 2585 B10R1.25 [13CH3]Sc1ccc(cc1F)Cl 62a_100011216042_200025704644 [1,1,0,0,0,0|2,0,0]=4 2586 B10R1.25 [13CH3]Sc1ccc(cc1F)Cl 62a_200025704644_100011216042 [1,1,0,0,0,0|2,0,0]=4 2587 B10R1.25 [13CH3]Sc1ccc(cc1F)F 62a_100000750030_200025704644 [1,1,0,0,0,0|2,0,0]=4 2588 B10R1.25 [13CH3]Sc1ccc(cc1F)F 62a_200025704644_100000750030 [1,1,0,0,0,0|2,0,0]=4 2589 B10R1.25 [13CH3]Sc1ccc(cc1F)N 62a_100011356925_200025704644 [1,1,0,0,0,0|2,0,0]=4 2590 B10R1.25 [13CH3]Sc1ccc(cc1F)N 62a_200025704644_100011356925 [1,1,0,0,0,0|2,0,0]=4 2591 B10R1.25 [13CH3]Sc1ccc(cc1F)O 62a_100000755031_200025704644 [1,1,0,0,0,0|2,0,0]=4 2592 B10R1.25 [13CH3]Sc1ccc(cc1F)O 62a_200025704644_100000755031 [1,1,0,0,0,0|2,0,0]=4 2593 B10R1.25 [13CH3]Sc1ccc(cc1N)Br 62a_100000743836_200025704644 [1,1,0,0,0,0|2,0,0]=4 2594 B10R1.25 [13CH3]Sc1ccc(cc1N)Br 62a_200025704644_100000743836 [1,1,0,0,0,0|2,0,0]=4 2595 B10R1.25 [13CH3]Sc1ccc(cc1N)Cl 62a_100000761886_200025704644 [1,1,0,0,0,0|2,0,0]=4 2596 B10R1.25 [13CH3]Sc1ccc(cc1N)Cl 62a_200025704644_100000761886 [1,1,0,0,0,0|2,0,0]=4 2597 B10R1.25 [13CH3]Sc1ccc(cc1N)F 62a_100000687223_200025704644 [1,1,0,0,0,0|2,0,0]=4 2598 B10R1.25 [13CH3]Sc1ccc(cc1N)F 62a_200025704644_100000687223 [1,1,0,0,0,0|2,0,0]=4 2599 B10R1.25 [13CH3]Sc1ccc(cc1N)N 62a_200012175722_200025704644 [1,1,0,0,0,0|2,0,0]=4 2600 B10R1.25 [13CH3]Sc1ccc(cc1N)N 62a_200025704644_200012175722 [1,1,0,0,0,0|2,0,0]=4 2601 B10R1.25 [13CH3]Sc1ccc(cc1N)O 62a_100011999798_200025704644 [1,1,0,0,0,0|2,0,0]=4 2602 B10R1.25 [13CH3]Sc1ccc(cc1N)O 62a_200025704644_100011999798 [1,1,0,0,0,0|2,0,0]=4 2603 B10R1.25 [13CH3]Sc1ccc(cc1O)Br 62a_100012344904_200025704644 [1,1,0,0,0,0|2,0,0]=4 2604 B10R1.25 [13CH3]Sc1ccc(cc1O)Br 62a_200025704644_100012344904 [1,1,0,0,0,0|2,0,0]=4 2605 B10R1.25 [13CH3]Sc1ccc(cc1O)Cl 62a_100000050036_200025704644 [1,1,0,0,0,0|2,0,0]=4 2606 B10R1.25 [13CH3]Sc1ccc(cc1O)Cl 62a_200025704644_100000050036 [1,1,0,0,0,0|2,0,0]=4 2607 B10R1.25 [13CH3]Sc1ccc(cc1O)F 62a_100000690578_200025704644 [1,1,0,0,0,0|2,0,0]=4 2608 B10R1.25 [13CH3]Sc1ccc(cc1O)F 62a_200025704644_100000690578 [1,1,0,0,0,0|2,0,0]=4 2609 B10R1.25 [13CH3]Sc1ccc(cc1O)O 62a_200025704644_100009813921 [1,1,0,0,0,0|2,0,0]=4 2610 B10R1.176 C=Cc1cc(c(cn1)C)C 271570a_100011290941_100009850809 [1,1,0,0,0,0|1,0,1]=4 2611 B10R1.176 C=Cc1cc(c(cn1)C)F 271570a_100011290941_100009841206 [1,1,0,0,0,0|1,0,1]=4 2612 B10R1.176 C=Cc1cc(c(cn1)C)N 271570a_100011290941_100000690170 [1,1,0,0,0,0|1,0,1]=4 2613 B10R1.176 C=Cc1cc(c(cn1)C)O 271570a_100011290941_100000704368 [1,1,0,0,0,0|1,0,1]=4 2614 B10R1.176 C=Cc1ccc([n+](c1)[O-])C 271570a_100011290941_100000703231 [1,1,0,0,0,0|1,0,1]=4 2615 B10R1.176 C=Cc1ccc(c(c1)Br)Br 271570a_100011290941_100012356285 [1,1,0,0,0,0|1,0,1]=4 2616 B10R1.176 C=Cc1ccc(c(c1)Br)C 271570a_100011290941_100011847877 [1,1,0,0,0,0|0,0,1]=3 2617 B10R1.176 C=Cc1ccc(c(c1)Br)Cl 271570a_100011290941_100012353702 [1,1,0,0,0,0|1,0,1]=4 2618 B10R1.176 C=Cc1ccc(c(c1)Br)F 271570a_100011290941_100012047266 [1,1,0,0,0,0|1,0,1]=4 2619 B10R1.176 C=Cc1ccc(c(c1)Br)N 271570a_100011290941_100000750455 [1,1,0,0,0,0|1,0,1]=4 2620 B10R1.176 C=Cc1ccc(c(c1)Br)O 271570a_100011290941_100012361655 [1,1,0,0,0,0|1,0,1]=4 2621 B10R1.176 C=Cc1ccc(c(c1)C)Br 271570a_100011290941_100009813585 [1,1,0,0,0,0|1,0,1]=4 2622 B10R1.176 C=Cc1ccc(c(c1)C)C 271570a_100011290941_100011215607 [1,1,0,0,0,0|0,0,1]=3 2623 B10R1.176 C=Cc1ccc(c(c1)C)Cl 271570a_100011290941_100000049509 [1,1,0,0,0,0|1,0,1]=4 2624 B10R1.176 C=Cc1ccc(c(c1)C)F 271570a_100011290941_100011218330 [1,1,0,0,0,0|1,0,1]=4 2625 B10R1.176 C=Cc1ccc(c(c1)C)N 271570a_100011290941_100000211769 [1,1,0,0,0,0|1,0,1]=4 2626 B10R1.176 C=Cc1ccc(c(c1)C)O 271570a_100011290941_100000186361 [1,1,0,0,0,0|1,0,1]=4 2627 B10R1.176 C=Cc1ccc(c(c1)Cl)Br 271570a_100011290941_100012047281 [1,1,0,0,0,0|1,0,1]=4 2628 B10R1.176 C=Cc1ccc(c(c1)Cl)C 271570a_100011290941_100011216363 [1,1,0,0,0,0|0,0,1]=3 2629 B10R1.176 C=Cc1ccc(c(c1)Cl)Cl 271570a_100011290941_100011214914 [1,1,0,0,0,0|1,0,1]=4 2630 B10R1.176 C=Cc1ccc(c(c1)Cl)F 271570a_100011290941_100011215976 [1,1,0,0,0,0|1,0,1]=4 2631 B10R1.176 C=Cc1ccc(c(c1)Cl)N 271570a_100011290941_100011218065 [1,1,0,0,0,0|1,0,1]=4 2632 B10R1.176 C=Cc1ccc(c(c1)Cl)O 271570a_100011290941_100012360047 [1,1,0,0,0,0|1,0,1]=4 2633 B10R1.176 C=Cc1ccc(c(c1)F)Br 271570a_100011290941_100000685389 [1,1,0,0,0,0|1,0,1]=4 2634 B10R1.176 C=Cc1ccc(c(c1)F)C 271570a_100011290941_100000720648 [1,1,0,0,0,0|0,0,1]=3 2635 B10R1.176 C=Cc1ccc(c(c1)F)Cl 271570a_100011290941_100011216805 [1,1,0,0,0,0|1,0,1]=4 2636 B10R1.176 C=Cc1ccc(c(c1)F)F 271570a_100011290941_100000750028 [1,1,0,0,0,0|1,0,1]=4 2637 B10R1.176 C=Cc1ccc(c(c1)F)N 271570a_100011290941_100011215594 [1,1,0,0,0,0|1,0,1]=4 2638 B10R1.176 C=Cc1ccc(c(c1)F)O 271570a_100011290941_100000185481 [1,1,0,0,0,0|1,0,1]=4 2639 B10R1.176 C=Cc1ccc(c(c1)N)Br 271570a_100011290941_100000750456 [1,1,0,0,0,0|1,0,1]=4 2640 B10R1.176 C=Cc1ccc(c(c1)N)C 271570a_100011290941_100000761890 [1,1,0,0,0,0|0,0,1]=3 2641 B10R1.176 C=Cc1ccc(c(c1)N)Cl 271570a_100011290941_200000761891 [1,1,0,0,0,0|1,0,1]=4 2642 B10R1.176 C=Cc1ccc(c(c1)N)F 271570a_100011290941_100000740924 [1,1,0,0,0,0|1,0,1]=4 2643 B10R1.176 C=Cc1ccc(c(c1)N)N 271570a_100011290941_100000741789 [1,1,0,0,0,0|1,0,1]=4 2644 B10R1.176 C=Cc1ccc(c(c1)N)O 271570a_100011290941_100000752626 [1,1,0,0,0,0|1,0,1]=4 2645 B10R1.176 C=Cc1ccc(c(c1)O)Br 271570a_100011290941_100012356990 [1,1,0,0,0,0|1,0,1]=4 2646 B10R1.176 C=Cc1ccc(c(c1)O)C 271570a_100011290941_100000766334 [1,1,0,0,0,0|0,0,1]=3 2647 B10R1.176 C=Cc1ccc(c(c1)O)Cl 271570a_100011290941_100011356854 [1,1,0,0,0,0|1,0,1]=4 2648 B10R1.176 C=Cc1ccc(c(c1)O)F 271570a_100011290941_100000686035 [1,1,0,0,0,0|1,0,1]=4 2649 B10R1.176 C=Cc1ccc(c(c1)O)N 271570a_100011290941_100000739049 [1,1,0,0,0,0|1,0,1]=4 2650 B10R1.176 C=Cc1ccc(c(c1)O)O 271570a_100011290941_100009813601 [1,1,0,0,0,0|1,0,1]=4 2651 B10R1.176 C=Cc1ccc(c(n1)C)C 271570a_100011290941_100000103781 [1,1,0,0,0,0|1,0,1]=4 2652 B10R1.176 C=Cc1ccc(c(n1)N)C 271570a_100011290941_100009857032 [1,1,0,0,0,0|1,0,1]=4 2653 B10R1.176 C=Cc1ccn(c(=O)c1)C 271570a_100011290941_100009820031 [1,1,0,0,0,0|1,0,1]=4 2654 B10R1.176 C=Cc1cnc(c(c1)C)C 271570a_100011290941_100000697892 [1,1,0,0,0,0|1,0,1]=4 2655 B10R1.176 C=Cc1cnc(c(c1)F)C 271570a_100011290941_100009845756 [1,1,0,0,0,0|1,0,1]=4 2656 B10R1.176 C=Cc1cnc(c(c1)N)C 271570a_100011290941_100011999542 [1,1,0,0,0,0|1,0,1]=4 2657 B10R1.176 C=Cc1cnc(c(c1)O)C 271570a_100011290941_100009864810 [1,1,0,0,0,0|1,0,1]=4 2658 B10R1.176 CCc1ccc(c(c1)Br)O 271570a_203496583355_200009997437 [1,1,0,0,0,0|1,0,1]=4 2659 B10R1.176 CCc1ccc(c(c1)F)O 271570a_203496583355_200010339503 [1,1,0,0,0,0|1,0,1]=4 2660 B10R1.176 CCc1ccc(c(c1)O)F 271570a_203496583355_200010244628 [1,1,0,0,0,0|1,0,1]=4 2661 B10R1.176 CCc1ccc(c(c1)O)N 271570a_203496583355_100012339725 [1,1,0,0,0,0|1,0,1]=4 2662 B10R1.176 CCc1ccc(c(c1)O)O 271570a_203496583355_100012339963 [1,1,0,0,0,0|1,0,1]=4 2663 B10R1.176 CNc1cc(c(cn1)C)F 27a_100102657272_100009841206 [1,1,0,0,0,0|2,0,0]=4 2664 B10R1.176 CNc1ccc(c(c1)Br)Br 2230a_100011306057_200000210301 [1,1,0,0,0,0|2,0,0]=4 2665 B10R1.176 CNc1ccc(c(c1)Br)Br 34a_100011306057_200000210301 [1,1,0,0,0,0|2,0,0]=4 2666 B10R1.176 CNc1ccc(c(c1)Br)Br 7a_100011306057_200000210301 [1,1,0,0,0,0|2,0,0]=4 2667 B10R1.176 CNc1ccc(c(c1)Br)C 2230a_100000736455_200000210301 [1,1,0,0,0,0|1,0,0]=3 2668 B10R1.176 CNc1ccc(c(c1)Br)C 34a_100000736455_200000210301 [1,1,0,0,0,0|1,0,0]=3 2669 B10R1.176 CNc1ccc(c(c1)Br)C 7a_100000736455_200000210301 [1,1,0,0,0,0|1,0,0]=3 2670 B10R1.176 CNc1ccc(c(c1)Br)Cl 2230a_100000686031_200000210301 [1,1,0,0,0,0|2,0,0]=4 2671 B10R1.176 CNc1ccc(c(c1)Br)Cl 34a_100000686031_200000210301 [1,1,0,0,0,0|2,0,0]=4 2672 B10R1.176 CNc1ccc(c(c1)Br)F 2230a_100000760356_200000210301 [1,1,0,0,0,0|2,0,0]=4 2673 B10R1.176 CNc1ccc(c(c1)Br)F 34a_100000760356_200000210301 [1,1,0,0,0,0|2,0,0]=4 2674 B10R1.176 CNc1ccc(c(c1)Br)F 7a_100000760356_200000210301 [1,1,0,0,0,0|2,0,0]=4 2675 B10R1.176 CNc1ccc(c(c1)Br)I 34a_100000750458_200000210301 [1,1,0,0,0,0|2,0,0]=4 2676 B10R1.176 CNc1ccc(c(c1)Br)O 34a_100011534360_200000210301 [1,1,0,0,0,0|2,0,0]=4 2677 B10R1.176 CNc1ccc(c(c1)C)Br 2230a_100000210723_200000210301 [1,1,0,0,0,0|2,0,0]=4 2678 B10R1.176 CNc1ccc(c(c1)C)Br 34a_100000210723_200000210301 [1,1,0,0,0,0|2,0,0]=4 2679 B10R1.176 CNc1ccc(c(c1)C)Br 7a_100000210723_200000210301 [1,1,0,0,0,0|2,0,0]=4 2680 B10R1.176 CNc1ccc(c(c1)C)C 2230a_100000724040_200000210301 [1,1,0,0,0,0|1,0,0]=3 2681 B10R1.176 CNc1ccc(c(c1)C)C 34a_100000724040_200000210301 [1,1,0,0,0,0|1,0,0]=3 2682 B10R1.176 CNc1ccc(c(c1)C)C 7a_100000724040_200000210301 [1,1,0,0,0,0|1,0,0]=3 2683 B10R1.176 CNc1ccc(c(c1)C)Cl 2230a_100000187808_200000210301 [1,1,0,0,0,0|2,0,0]=4 2684 B10R1.176 CNc1ccc(c(c1)C)Cl 34a_100000187808_200000210301 [1,1,0,0,0,0|2,0,0]=4 2685 B10R1.176 CNc1ccc(c(c1)C)Cl 7a_100000187808_200000210301 [1,1,0,0,0,0|2,0,0]=4 2686 B10R1.176 CNc1ccc(c(c1)C)F 2230a_100000750164_200000210301 [1,1,0,0,0,0|2,0,0]=4 2687 B10R1.176 CNc1ccc(c(c1)C)F 34a_100000750164_200000210301 [1,1,0,0,0,0|2,0,0]=4 2688 B10R1.176 CNc1ccc(c(c1)C)F 7a_100000750164_200000210301 [1,1,0,0,0,0|2,0,0]=4 2689 B10R1.176 CNc1ccc(c(c1)C)I 34a_100000198070_200000210301 [1,1,0,0,0,0|2,0,0]=4 2690 B10R1.176 CNc1ccc(c(c1)C)I 7a_100000198070_200000210301 [1,1,0,0,0,0|2,0,0]=4 2691 B10R1.176 CNc1ccc(c(c1)C)O 271570a_203496583355_100102888905 [1,1,0,0,0,0|2,0,0]=4 2692 B10R1.176 CNc1ccc(c(c1)C)O 34a_100011218179_200000210301 [1,1,0,0,0,0|2,0,0]=4 2693 B10R1.176 CNc1ccc(c(c1)C)O 7a_100011218179_200000210301 [1,1,0,0,0,0|2,0,0]=4 2694 B10R1.176 CNc1ccc(c(c1)Cl)Br 2230a_100000687081_200000210301 [1,1,0,0,0,0|2,0,0]=4 2695 B10R1.176 CNc1ccc(c(c1)Cl)Br 34a_100000687081_200000210301 [1,1,0,0,0,0|2,0,0]=4 2696 B10R1.176 CNc1ccc(c(c1)Cl)Br 7a_100000687081_200000210301 [1,1,0,0,0,0|2,0,0]=4 2697 B10R1.176 CNc1ccc(c(c1)Cl)C 2230a_100000188892_200000210301 [1,1,0,0,0,0|1,0,0]=3 2698 B10R1.176 CNc1ccc(c(c1)Cl)C 34a_100000188892_200000210301 [1,1,0,0,0,0|1,0,0]=3 2699 B10R1.176 CNc1ccc(c(c1)Cl)C 7a_100000188892_200000210301 [1,1,0,0,0,0|1,0,0]=3 2700 B10R1.176 CNc1ccc(c(c1)Cl)Cl 2230a_100000184108_200000210301 [1,1,0,0,0,0|2,0,0]=4 2701 B10R1.176 CNc1ccc(c(c1)Cl)Cl 34a_100000184108_200000210301 [1,1,0,0,0,0|2,0,0]=4 2702 B10R1.176 CNc1ccc(c(c1)Cl)F 2230a_100000211060_200000210301 [1,1,0,0,0,0|2,0,0]=4 2703 B10R1.176 CNc1ccc(c(c1)Cl)F 34a_100000211060_200000210301 [1,1,0,0,0,0|2,0,0]=4 2704 B10R1.176 CNc1ccc(c(c1)Cl)F 7a_100000211060_200000210301 [1,1,0,0,0,0|2,0,0]=4 2705 B10R1.176 CNc1ccc(c(c1)Cl)I 34a_100000761885_200000210301 [1,1,0,0,0,0|2,0,0]=4 2706 B10R1.176 CNc1ccc(c(c1)Cl)O 34a_100000744943_200000210301 [1,1,0,0,0,0|2,0,0]=4 2707 B10R1.176 CNc1ccc(c(c1)F)Br 2230a_100000759894_200000210301 [1,1,0,0,0,0|2,0,0]=4 2708 B10R1.176 CNc1ccc(c(c1)F)Br 34a_100000759894_200000210301 [1,1,0,0,0,0|2,0,0]=4 2709 B10R1.176 CNc1ccc(c(c1)F)Br 7a_100000759894_200000210301 [1,1,0,0,0,0|2,0,0]=4 2710 B10R1.176 CNc1ccc(c(c1)F)C 2230a_100000210958_200000210301 [1,1,0,0,0,0|1,0,0]=3 2711 B10R1.176 CNc1ccc(c(c1)F)C 34a_100000210958_200000210301 [1,1,0,0,0,0|1,0,0]=3 2712 B10R1.176 CNc1ccc(c(c1)F)C 7a_100000210958_200000210301 [1,1,0,0,0,0|1,0,0]=3 2713 B10R1.176 CNc1ccc(c(c1)F)Cl 2230a_100000739366_200000210301 [1,1,0,0,0,0|2,0,0]=4 2714 B10R1.176 CNc1ccc(c(c1)F)Cl 34a_100000739366_200000210301 [1,1,0,0,0,0|2,0,0]=4 2715 B10R1.176 CNc1ccc(c(c1)F)Cl 7a_100000739366_200000210301 [1,1,0,0,0,0|2,0,0]=4 2716 B10R1.176 CNc1ccc(c(c1)F)F 2230a_100000210724_200000210301 [1,1,0,0,0,0|2,0,0]=4 2717 B10R1.176 CNc1ccc(c(c1)F)F 34a_100000210724_200000210301 [1,1,0,0,0,0|2,0,0]=4 2718 B10R1.176 CNc1ccc(c(c1)F)F 7a_100000210724_200000210301 [1,1,0,0,0,0|2,0,0]=4 2719 B10R1.176 CNc1ccc(c(c1)F)I 34a_100011356925_200000210301 [1,1,0,0,0,0|2,0,0]=4 2720 B10R1.176 CNc1ccc(c(c1)F)I 7a_100011356925_200000210301 [1,1,0,0,0,0|2,0,0]=4 2721 B10R1.176 CNc1ccc(c(c1)F)O 271570a_203496583355_100012285320 [1,1,0,0,0,0|2,0,0]=4 2722 B10R1.176 CNc1ccc(c(c1)F)O 34a_100011220035_200000210301 [1,1,0,0,0,0|2,0,0]=4 2723 B10R1.176 CNc1ccc(c(c1)F)O 7a_100011220035_200000210301 [1,1,0,0,0,0|2,0,0]=4 2724 B10R1.176 CNc1ccc(c(c1)I)Br 34a_100000750459_200000210301 [1,1,0,0,0,0|2,0,0]=4 2725 B10R1.176 CNc1ccc(c(c1)I)C 34a_100000184131_200000210301 [1,1,0,0,0,0|1,0,0]=3 2726 B10R1.176 CNc1ccc(c(c1)I)C 7a_100000184131_200000210301 [1,1,0,0,0,0|1,0,0]=3 2727 B10R1.176 CNc1ccc(c(c1)I)Cl 34a_100012360549_200000210301 [1,1,0,0,0,0|2,0,0]=4 2728 B10R1.176 CNc1ccc(c(c1)I)F 34a_114828291077_200000210301 [1,1,0,0,0,0|2,0,0]=4 2729 B10R1.176 CNc1ccc(c(c1)I)F 7a_114828291077_200000210301 [1,1,0,0,0,0|2,0,0]=4 2730 B10R1.176 CNc1ccc(c(c1)O)C 271570a_203496583355_100000707694 [1,1,0,0,0,0|1,0,0]=3 2731 B10R1.176 CNc1ccc(c(c1)O)C 34a_100000759471_200000210301 [1,1,0,0,0,0|1,0,0]=3 2732 B10R1.176 CNc1ccc(c(c1)O)C 7a_100000759471_200000210301 [1,1,0,0,0,0|1,0,0]=3 2733 B10R1.176 CNc1ccc(c(c1)O)Cl 34a_100011934209_200000210301 [1,1,0,0,0,0|2,0,0]=4 2734 B10R1.176 CNc1ccc(c(c1)O)F 34a_100012017398_200000210301 [1,1,0,0,0,0|2,0,0]=4 2735 B10R1.176 CNc1ccc(c(c1)O)F 7a_100012017398_200000210301 [1,1,0,0,0,0|2,0,0]=4 2736 B10R1.176 CNc1ccc(c(c1)O)O 34a_100102946323_200000210301 [1,1,0,0,0,0|2,0,0]=4 2737 B10R1.176 CNc1ccn(c(=O)c1)C 27a_100102657272_100009820031 [1,1,0,0,0,0|2,0,0]=4 2738 B10R1.176 COc1cc(c(cn1)C)Br 34a_100009831917_200000210301 [1,1,0,0,0,0|2,0,0]=4 2739 B10R1.176 COc1cc(c(cn1)C)O 271570a_203496583355_100010068546 [1,1,0,0,0,0|2,0,0]=4 2740 B10R1.176 COc1ccc(c(c1)Br)C 34a_100011380479_200000210301 [1,1,0,0,0,0|1,0,0]=3 2741 B10R1.176 COc1ccc(c(c1)Br)C 7a_100011380479_200000210301 [1,1,0,0,0,0|1,0,0]=3 2742 B10R1.176 COc1ccc(c(c1)Br)Cl 34a_100011933957_200000210301 [1,1,0,0,0,0|2,0,0]=4 2743 B10R1.176 COc1ccc(c(c1)Br)Cl 7a_100011933957_200000210301 [1,1,0,0,0,0|2,0,0]=4 2744 B10R1.176 COc1ccc(c(c1)Br)F 34a_100000693481_200000210301 [1,1,0,0,0,0|2,0,0]=4 2745 B10R1.176 COc1ccc(c(c1)Br)F 7a_100000693481_200000210301 [1,1,0,0,0,0|2,0,0]=4 2746 B10R1.176 COc1ccc(c(c1)Br)I 34a_100000701344_200000210301 [1,1,0,0,0,0|2,0,0]=4 2747 B10R1.176 COc1ccc(c(c1)Br)I 7a_100000701344_200000210301 [1,1,0,0,0,0|2,0,0]=4 2748 B10R1.176 COc1ccc(c(c1)Br)N 34a_100012001276_200000210301 [1,1,0,0,0,0|2,0,0]=4 2749 B10R1.176 COc1ccc(c(c1)Br)N 7a_100012001276_200000210301 [1,1,0,0,0,0|2,0,0]=4 2750 B10R1.176 COc1ccc(c(c1)Br)O 271570a_203496583355_100012349170 [1,1,0,0,0,0|2,0,0]=4 2751 B10R1.176 COc1ccc(c(c1)C)Br 34a_100000690111_200000210301 [1,1,0,0,0,0|2,0,0]=4 2752 B10R1.176 COc1ccc(c(c1)C)Br 7a_100000690111_200000210301 [1,1,0,0,0,0|2,0,0]=4 2753 B10R1.176 COc1ccc(c(c1)C)C 34a_100000210932_200000210301 [1,1,0,0,0,0|1,0,0]=3 2754 B10R1.176 COc1ccc(c(c1)C)C 7a_100000210932_200000210301 [1,1,0,0,0,0|1,0,0]=3 2755 B10R1.176 COc1ccc(c(c1)C)Cl 34a_100000211092_200000210301 [1,1,0,0,0,0|2,0,0]=4 2756 B10R1.176 COc1ccc(c(c1)C)Cl 7a_100000211092_200000210301 [1,1,0,0,0,0|2,0,0]=4 2757 B10R1.176 COc1ccc(c(c1)C)F 34a_100000751312_200000210301 [1,1,0,0,0,0|2,0,0]=4 2758 B10R1.176 COc1ccc(c(c1)C)F 7a_100000751312_200000210301 [1,1,0,0,0,0|2,0,0]=4 2759 B10R1.176 COc1ccc(c(c1)C)I 34a_100000729255_200000210301 [1,1,0,0,0,0|2,0,0]=4 2760 B10R1.176 COc1ccc(c(c1)C)I 7a_100000729255_200000210301 [1,1,0,0,0,0|2,0,0]=4 2761 B10R1.176 COc1ccc(c(c1)C)N 34a_100000756630_200000210301 [1,1,0,0,0,0|2,0,0]=4 2762 B10R1.176 COc1ccc(c(c1)C)N 7a_100000756630_200000210301 [1,1,0,0,0,0|2,0,0]=4 2763 B10R1.176 COc1ccc(c(c1)C)O 271570a_203496583355_100000759875 [1,1,0,0,0,0|2,0,0]=4 2764 B10R1.176 COc1ccc(c(c1)Cl)Br 34a_100011215161_200000210301 [1,1,0,0,0,0|2,0,0]=4 2765 B10R1.176 COc1ccc(c(c1)Cl)Br 7a_100011215161_200000210301 [1,1,0,0,0,0|2,0,0]=4 2766 B10R1.176 COc1ccc(c(c1)Cl)C 34a_100011265682_200000210301 [1,1,0,0,0,0|1,0,0]=3 2767 B10R1.176 COc1ccc(c(c1)Cl)C 7a_100011265682_200000210301 [1,1,0,0,0,0|1,0,0]=3 2768 B10R1.176 COc1ccc(c(c1)Cl)Cl 34a_100000211054_200000210301 [1,1,0,0,0,0|2,0,0]=4 2769 B10R1.176 COc1ccc(c(c1)Cl)Cl 7a_100000211054_200000210301 [1,1,0,0,0,0|2,0,0]=4 2770 B10R1.176 COc1ccc(c(c1)Cl)F 34a_100000211030_200000210301 [1,1,0,0,0,0|2,0,0]=4 2771 B10R1.176 COc1ccc(c(c1)Cl)F 7a_100000211030_200000210301 [1,1,0,0,0,0|2,0,0]=4 2772 B10R1.176 COc1ccc(c(c1)Cl)I 34a_100000047559_200000210301 [1,1,0,0,0,0|2,0,0]=4 2773 B10R1.176 COc1ccc(c(c1)Cl)I 7a_100000047559_200000210301 [1,1,0,0,0,0|2,0,0]=4 2774 B10R1.176 COc1ccc(c(c1)Cl)N 34a_100011215599_200000210301 [1,1,0,0,0,0|2,0,0]=4 2775 B10R1.176 COc1ccc(c(c1)Cl)N 7a_100011215599_200000210301 [1,1,0,0,0,0|2,0,0]=4 2776 B10R1.176 COc1ccc(c(c1)F)Br 34a_100000755031_200000210301 [1,1,0,0,0,0|2,0,0]=4 2777 B10R1.176 COc1ccc(c(c1)F)Br 7a_100000755031_200000210301 [1,1,0,0,0,0|2,0,0]=4 2778 B10R1.176 COc1ccc(c(c1)F)C 34a_100000722560_200000210301 [1,1,0,0,0,0|1,0,0]=3 2779 B10R1.176 COc1ccc(c(c1)F)C 7a_100000722560_200000210301 [1,1,0,0,0,0|1,0,0]=3 2780 B10R1.176 COc1ccc(c(c1)F)Cl 34a_100000691581_200000210301 [1,1,0,0,0,0|2,0,0]=4 2781 B10R1.176 COc1ccc(c(c1)F)Cl 7a_100000691581_200000210301 [1,1,0,0,0,0|2,0,0]=4 2782 B10R1.176 COc1ccc(c(c1)F)F 34a_100000181275_200000210301 [1,1,0,0,0,0|2,0,0]=4 2783 B10R1.176 COc1ccc(c(c1)F)F 7a_100000181275_200000210301 [1,1,0,0,0,0|2,0,0]=4 2784 B10R1.176 COc1ccc(c(c1)F)I 34a_100009990212_200000210301 [1,1,0,0,0,0|2,0,0]=4 2785 B10R1.176 COc1ccc(c(c1)F)I 7a_100009990212_200000210301 [1,1,0,0,0,0|2,0,0]=4 2786 B10R1.176 COc1ccc(c(c1)F)N 34a_100000759473_200000210301 [1,1,0,0,0,0|2,0,0]=4 2787 B10R1.176 COc1ccc(c(c1)F)N 7a_100000759473_200000210301 [1,1,0,0,0,0|2,0,0]=4 2788 B10R1.176 COc1ccc(c(c1)F)O 271570a_203496583355_100000753793 [1,1,0,0,0,0|2,0,0]=4 2789 B10R1.176 COc1ccc(c(c1)I)Br 34a_100012339312_200000210301 [1,1,0,0,0,0|2,0,0]=4 2790 B10R1.176 COc1ccc(c(c1)I)Br 7a_100012339312_200000210301 [1,1,0,0,0,0|2,0,0]=4 2791 B10R1.176 COc1ccc(c(c1)I)Cl 34a_100000049588_200000210301 [1,1,0,0,0,0|2,0,0]=4 2792 B10R1.176 COc1ccc(c(c1)I)Cl 7a_100000049588_200000210301 [1,1,0,0,0,0|2,0,0]=4 2793 B10R1.176 COc1ccc(c(c1)I)N 34a_100010084370_200000210301 [1,1,0,0,0,0|2,0,0]=4 2794 B10R1.176 COc1ccc(c(c1)I)N 7a_100010084370_200000210301 [1,1,0,0,0,0|2,0,0]=4 2795 B10R1.176 COc1ccc(c(c1)N)Br 34a_100011999798_200000210301 [1,1,0,0,0,0|2,0,0]=4 2796 B10R1.176 COc1ccc(c(c1)N)Br 7a_100011999798_200000210301 [1,1,0,0,0,0|2,0,0]=4 2797 B10R1.176 COc1ccc(c(c1)N)C 34a_100011216113_200000210301 [1,1,0,0,0,0|1,0,0]=3 2798 B10R1.176 COc1ccc(c(c1)N)C 7a_100011216113_200000210301 [1,1,0,0,0,0|1,0,0]=3 2799 B10R1.176 COc1ccc(c(c1)N)Cl 34a_100011934297_200000210301 [1,1,0,0,0,0|2,0,0]=4 2800 B10R1.176 COc1ccc(c(c1)N)F 34a_100012017239_200000210301 [1,1,0,0,0,0|2,0,0]=4 2801 B10R1.176 COc1ccc(c(c1)N)F 7a_100012017239_200000210301 [1,1,0,0,0,0|2,0,0]=4 2802 B10R1.176 COc1ccc(c(c1)N)N 34a_100025771000_200000210301 [1,1,0,0,0,0|2,0,0]=4 2803 B10R1.176 COc1ccc(c(c1)N)O 271570a_203496583355_100000748021 [1,1,0,0,0,0|2,0,0]=4 2804 B10R1.176 COc1ccc(c(c1)O)Br 271570a_203496583355_100009992028 [1,1,0,0,0,0|2,0,0]=4 2805 B10R1.176 COc1ccc(c(c1)O)C 271570a_203496583355_100012349166 [1,1,0,0,0,0|1,0,0]=3 2806 B10R1.176 COc1ccc(c(c1)O)Cl 271570a_203496583355_100011356938 [1,1,0,0,0,0|2,0,0]=4 2807 B10R1.176 COc1ccc(c(c1)O)F 271570a_203496583355_100000699733 [1,1,0,0,0,0|2,0,0]=4 2808 B10R1.176 COc1ccc(c(c1)O)N 271570a_203496583355_100015195136 [1,1,0,0,0,0|2,0,0]=4 2809 B10R1.176 COc1ccc(c(c1)O)O 271570a_203496583355_100000685887 [1,1,0,0,0,0|2,0,0]=4 2810 B10R1.176 COc1ccc(c(c1)O)O 271570a_203496583355_100000719091 [1,1,0,0,0,0|2,0,0]=4 2811 B10R1.176 COc1cnc(c(c1)Br)C 34a_100009819603_200000210301 [1,1,0,0,0,0|2,0,0]=4 2812 B10R1.176 COc1cnc(c(c1)Br)C 7a_100009819603_200000210301 [1,1,0,0,0,0|2,0,0]=4 2813 B10R1.176 COc1cnc(c(c1)C)C 34a_100009854398_200000210301 [1,1,0,0,0,0|2,0,0]=4 2814 B10R1.176 COc1cnc(c(c1)C)C 7a_100009854398_200000210301 [1,1,0,0,0,0|2,0,0]=4 2815 B10R1.176 CSc1cc(c(cn1)C)C 62a_100009850809_200000210301 [1,1,0,0,0,0|2,0,0]=4 2816 B10R1.176 CSc1cc(c(cn1)C)C 62a_200000210301_100009850809 [1,1,0,0,0,0|2,0,0]=4 2817 B10R1.176 CSc1cc(c(cn1)C)F 62a_100009841206_200000210301 [1,1,0,0,0,0|2,0,0]=4 2818 B10R1.176 CSc1cc(c(cn1)C)F 62a_200000210301_100009841206 [1,1,0,0,0,0|2,0,0]=4 2819 B10R1.176 CSc1cc(c(cn1)C)N 62a_100000126663_200000210301 [1,1,0,0,0,0|2,0,0]=4 2820 B10R1.176 CSc1cc(c(cn1)C)N 62a_200000210301_100000126663 [1,1,0,0,0,0|2,0,0]=4 2821 B10R1.176 CSc1cc(c(cn1)C)O 62a_100000704368_200000210301 [1,1,0,0,0,0|2,0,0]=4 2822 B10R1.176 CSc1cc(c(cn1)C)O 62a_200000210301_100000704368 [1,1,0,0,0,0|2,0,0]=4 2823 B10R1.176 CSc1ccc([n+](c1)[O-])C 62a_200000210301_100000703231 [1,1,0,0,0,0|2,0,0]=4 2824 B10R1.176 CSc1ccc(c(c1)Br)Br 62a_100012356285_200000210301 [1,1,0,0,0,0|2,0,0]=4 2825 B10R1.176 CSc1ccc(c(c1)Br)Br 62a_200000210301_100012356285 [1,1,0,0,0,0|2,0,0]=4 2826 B10R1.176 CSc1ccc(c(c1)Br)C 62a_100011847877_200000210301 [1,1,0,0,0,0|1,0,0]=3 2827 B10R1.176 CSc1ccc(c(c1)Br)C 62a_200000210301_100011847877 [1,1,0,0,0,0|1,0,0]=3 2828 B10R1.176 CSc1ccc(c(c1)Br)Cl 62a_100012353702_200000210301 [1,1,0,0,0,0|2,0,0]=4 2829 B10R1.176 CSc1ccc(c(c1)Br)Cl 62a_200000210301_100012353702 [1,1,0,0,0,0|2,0,0]=4 2830 B10R1.176 CSc1ccc(c(c1)Br)F 62a_100012047266_200000210301 [1,1,0,0,0,0|2,0,0]=4 2831 B10R1.176 CSc1ccc(c(c1)Br)F 62a_200000210301_100012047266 [1,1,0,0,0,0|2,0,0]=4 2832 B10R1.176 CSc1ccc(c(c1)Br)N 62a_100000750455_200000210301 [1,1,0,0,0,0|2,0,0]=4 2833 B10R1.176 CSc1ccc(c(c1)Br)N 62a_200000210301_100000750455 [1,1,0,0,0,0|2,0,0]=4 2834 B10R1.176 CSc1ccc(c(c1)Br)O 62a_100012361655_200000210301 [1,1,0,0,0,0|2,0,0]=4 2835 B10R1.176 CSc1ccc(c(c1)Br)O 62a_200000210301_100012361655 [1,1,0,0,0,0|2,0,0]=4 2836 B10R1.176 CSc1ccc(c(c1)C)Br 62a_100009813585_200000210301 [1,1,0,0,0,0|2,0,0]=4 2837 B10R1.176 CSc1ccc(c(c1)C)Br 62a_200000210301_100009813585 [1,1,0,0,0,0|2,0,0]=4 2838 B10R1.176 CSc1ccc(c(c1)C)C 62a_100011215607_200000210301 [1,1,0,0,0,0|1,0,0]=3 2839 B10R1.176 CSc1ccc(c(c1)C)C 62a_200000210301_100011215607 [1,1,0,0,0,0|1,0,0]=3 2840 B10R1.176 CSc1ccc(c(c1)C)Cl 62a_100000049509_200000210301 [1,1,0,0,0,0|2,0,0]=4 2841 B10R1.176 CSc1ccc(c(c1)C)Cl 62a_200000210301_100000049509 [1,1,0,0,0,0|2,0,0]=4 2842 B10R1.176 CSc1ccc(c(c1)C)F 62a_100011218330_200000210301 [1,1,0,0,0,0|2,0,0]=4 2843 B10R1.176 CSc1ccc(c(c1)C)F 62a_200000210301_100011218330 [1,1,0,0,0,0|2,0,0]=4 2844 B10R1.176 CSc1ccc(c(c1)C)N 62a_100000211769_200000210301 [1,1,0,0,0,0|2,0,0]=4 2845 B10R1.176 CSc1ccc(c(c1)C)N 62a_200000210301_100000211769 [1,1,0,0,0,0|2,0,0]=4 2846 B10R1.176 CSc1ccc(c(c1)C)O 62a_200000210301_100000186361 [1,1,0,0,0,0|2,0,0]=4 2847 B10R1.176 CSc1ccc(c(c1)Cl)Br 62a_100012047281_200000210301 [1,1,0,0,0,0|2,0,0]=4 2848 B10R1.176 CSc1ccc(c(c1)Cl)Br 62a_200000210301_100012047281 [1,1,0,0,0,0|2,0,0]=4 2849 B10R1.176 CSc1ccc(c(c1)Cl)C 62a_100011216363_200000210301 [1,1,0,0,0,0|1,0,0]=3 2850 B10R1.176 CSc1ccc(c(c1)Cl)C 62a_200000210301_100011216363 [1,1,0,0,0,0|1,0,0]=3 2851 B10R1.176 CSc1ccc(c(c1)Cl)Cl 62a_100011214914_200000210301 [1,1,0,0,0,0|2,0,0]=4 2852 B10R1.176 CSc1ccc(c(c1)Cl)Cl 62a_200000210301_100011214914 [1,1,0,0,0,0|2,0,0]=4 2853 B10R1.176 CSc1ccc(c(c1)Cl)F 62a_100011215976_200000210301 [1,1,0,0,0,0|2,0,0]=4 2854 B10R1.176 CSc1ccc(c(c1)Cl)F 62a_200000210301_100011215976 [1,1,0,0,0,0|2,0,0]=4 2855 B10R1.176 CSc1ccc(c(c1)Cl)N 62a_100011218065_200000210301 [1,1,0,0,0,0|2,0,0]=4 2856 B10R1.176 CSc1ccc(c(c1)Cl)N 62a_200000210301_100011218065 [1,1,0,0,0,0|2,0,0]=4 2857 B10R1.176 CSc1ccc(c(c1)Cl)O 62a_100012360047_200000210301 [1,1,0,0,0,0|2,0,0]=4 2858 B10R1.176 CSc1ccc(c(c1)Cl)O 62a_200000210301_100012360047 [1,1,0,0,0,0|2,0,0]=4 2859 B10R1.176 CSc1ccc(c(c1)F)Br 62a_100000685389_200000210301 [1,1,0,0,0,0|2,0,0]=4 2860 B10R1.176 CSc1ccc(c(c1)F)Br 62a_200000210301_100000685389 [1,1,0,0,0,0|2,0,0]=4 2861 B10R1.176 CSc1ccc(c(c1)F)C 62a_100000720648_200000210301 [1,1,0,0,0,0|1,0,0]=3 2862 B10R1.176 CSc1ccc(c(c1)F)C 62a_200000210301_100000720648 [1,1,0,0,0,0|1,0,0]=3 2863 B10R1.176 CSc1ccc(c(c1)F)Cl 62a_100011216805_200000210301 [1,1,0,0,0,0|2,0,0]=4 2864 B10R1.176 CSc1ccc(c(c1)F)Cl 62a_200000210301_100011216805 [1,1,0,0,0,0|2,0,0]=4 2865 B10R1.176 CSc1ccc(c(c1)F)F 62a_100000703953_200000210301 [1,1,0,0,0,0|2,0,0]=4 2866 B10R1.176 CSc1ccc(c(c1)F)F 62a_200000210301_100000703953 [1,1,0,0,0,0|2,0,0]=4 2867 B10R1.176 CSc1ccc(c(c1)F)N 62a_100011215594_200000210301 [1,1,0,0,0,0|2,0,0]=4 2868 B10R1.176 CSc1ccc(c(c1)F)N 62a_200000210301_100011215594 [1,1,0,0,0,0|2,0,0]=4 2869 B10R1.176 CSc1ccc(c(c1)F)O 271570a_203496583355_100009816902 [1,1,0,0,0,0|2,0,0]=4 2870 B10R1.176 CSc1ccc(c(c1)F)O 62a_100000185481_200000210301 [1,1,0,0,0,0|2,0,0]=4 2871 B10R1.176 CSc1ccc(c(c1)F)O 62a_200000210301_100000185481 [1,1,0,0,0,0|2,0,0]=4 2872 B10R1.176 CSc1ccc(c(c1)N)Br 62a_100000750456_200000210301 [1,1,0,0,0,0|2,0,0]=4 2873 B10R1.176 CSc1ccc(c(c1)N)Br 62a_200000210301_100000750456 [1,1,0,0,0,0|2,0,0]=4 2874 B10R1.176 CSc1ccc(c(c1)N)C 62a_100000761890_200000210301 [1,1,0,0,0,0|1,0,0]=3 2875 B10R1.176 CSc1ccc(c(c1)N)C 62a_200000210301_100000761890 [1,1,0,0,0,0|1,0,0]=3 2876 B10R1.176 CSc1ccc(c(c1)N)Cl 62a_200000210301_200000761891 [1,1,0,0,0,0|2,0,0]=4 2877 B10R1.176 CSc1ccc(c(c1)N)Cl 62a_200000761891_200000210301 [1,1,0,0,0,0|2,0,0]=4 2878 B10R1.176 CSc1ccc(c(c1)N)F 62a_100000740924_200000210301 [1,1,0,0,0,0|2,0,0]=4 2879 B10R1.176 CSc1ccc(c(c1)N)F 62a_200000210301_100000740924 [1,1,0,0,0,0|2,0,0]=4 2880 B10R1.176 CSc1ccc(c(c1)N)N 62a_100000741789_200000210301 [1,1,0,0,0,0|2,0,0]=4 2881 B10R1.176 CSc1ccc(c(c1)N)N 62a_200000210301_100011534411 [1,1,0,0,0,0|2,0,0]=4 2882 B10R1.176 CSc1ccc(c(c1)N)O 62a_100000752626_200000210301 [1,1,0,0,0,0|2,0,0]=4 2883 B10R1.176 CSc1ccc(c(c1)N)O 62a_200000210301_100000752626 [1,1,0,0,0,0|2,0,0]=4 2884 B10R1.176 CSc1ccc(c(c1)O)Br 62a_100012356990_200000210301 [1,1,0,0,0,0|2,0,0]=4 2885 B10R1.176 CSc1ccc(c(c1)O)Br 62a_200000210301_100012356990 [1,1,0,0,0,0|2,0,0]=4 2886 B10R1.176 CSc1ccc(c(c1)O)C 62a_100000685420_200000210301 [1,1,0,0,0,0|1,0,0]=3 2887 B10R1.176 CSc1ccc(c(c1)O)C 62a_200000210301_100000685420 [1,1,0,0,0,0|1,0,0]=3 2888 B10R1.176 CSc1ccc(c(c1)O)Cl 62a_100011356854_200000210301 [1,1,0,0,0,0|2,0,0]=4 2889 B10R1.176 CSc1ccc(c(c1)O)Cl 62a_200000210301_100011356854 [1,1,0,0,0,0|2,0,0]=4 2890 B10R1.176 CSc1ccc(c(c1)O)F 271570a_203496583355_200010708804 [1,1,0,0,0,0|2,0,0]=4 2891 B10R1.176 CSc1ccc(c(c1)O)F 62a_100000686035_200000210301 [1,1,0,0,0,0|2,0,0]=4 2892 B10R1.176 CSc1ccc(c(c1)O)F 62a_200000210301_100000686035 [1,1,0,0,0,0|2,0,0]=4 2893 B10R1.176 CSc1ccc(c(c1)O)N 62a_100000739049_200000210301 [1,1,0,0,0,0|2,0,0]=4 2894 B10R1.176 CSc1ccc(c(c1)O)N 62a_200000210301_100000739049 [1,1,0,0,0,0|2,0,0]=4 2895 B10R1.176 CSc1ccc(c(c1)O)O 62a_200000210301_100009813601 [1,1,0,0,0,0|2,0,0]=4 2896 B10R1.176 CSc1ccc(c(n1)C)C 62a_100000103781_200000210301 [1,1,0,0,0,0|2,0,0]=4 2897 B10R1.176 CSc1ccc(c(n1)C)C 62a_200000210301_100000103781 [1,1,0,0,0,0|2,0,0]=4 2898 B10R1.176 CSc1ccc(c(n1)N)C 62a_100009857032_200000210301 [1,1,0,0,0,0|2,0,0]=4 2899 B10R1.176 CSc1ccc(c(n1)N)C 62a_200000210301_100009857032 [1,1,0,0,0,0|2,0,0]=4 2900 B10R1.176 CSc1ccn(c(=O)c1)C 62a_100009820031_200000210301 [1,1,0,0,0,0|2,0,0]=4 2901 B10R1.176 CSc1ccn(c(=O)c1)C 62a_200000210301_100009820031 [1,1,0,0,0,0|2,0,0]=4 2902 B10R1.176 CSc1cnc(c(c1)C)C 62a_100000697892_200000210301 [1,1,0,0,0,0|2,0,0]=4 2903 B10R1.176 CSc1cnc(c(c1)C)C 62a_200000210301_100000697892 [1,1,0,0,0,0|2,0,0]=4 2904 B10R1.176 CSc1cnc(c(c1)F)C 62a_100009845756_200000210301 [1,1,0,0,0,0|2,0,0]=4 2905 B10R1.176 CSc1cnc(c(c1)F)C 62a_200000210301_100009845756 [1,1,0,0,0,0|2,0,0]=4 2906 B10R1.176 CSc1cnc(c(c1)N)C 62a_100011999542_200000210301 [1,1,0,0,0,0|2,0,0]=4 2907 B10R1.176 CSc1cnc(c(c1)N)C 62a_200000210301_100011999542 [1,1,0,0,0,0|2,0,0]=4 2908 B10R1.176 CSc1cnc(c(c1)O)C 62a_100009864810_200000210301 [1,1,0,0,0,0|2,0,0]=4 2909 B10R1.176 CSc1cnc(c(c1)O)C 62a_200000210301_100009864810 [1,1,0,0,0,0|2,0,0]=4 2910 B10R1.176 Cc1cc(ccc1Br)N[13CH3] 2230a_100000210723_200025704644 [1,1,0,0,0,0|2,0,0]=4 2911 B10R1.176 Cc1cc(ccc1Br)N[13CH3] 34a_100000210723_200025704644 [1,1,0,0,0,0|2,0,0]=4 2912 B10R1.176 Cc1cc(ccc1Br)N[13CH3] 7a_100000210723_200025704644 [1,1,0,0,0,0|2,0,0]=4 2913 B10R1.176 Cc1cc(ccc1Br)O[13CH3] 34a_100000690111_200025704644 [1,1,0,0,0,0|2,0,0]=4 2914 B10R1.176 Cc1cc(ccc1Br)O[13CH3] 7a_100000690111_200025704644 [1,1,0,0,0,0|2,0,0]=4 2915 B10R1.176 Cc1cc(ccc1Br)S[13CH3] 62a_100009813585_200025704644 [1,1,0,0,0,0|2,0,0]=4 2916 B10R1.176 Cc1cc(ccc1Br)S[13CH3] 62a_200025704644_100009813585 [1,1,0,0,0,0|2,0,0]=4 2917 B10R1.176 Cc1cc(ccc1Cl)N[13CH3] 2230a_100000187808_200025704644 [1,1,0,0,0,0|2,0,0]=4 2918 B10R1.176 Cc1cc(ccc1Cl)N[13CH3] 34a_100000187808_200025704644 [1,1,0,0,0,0|2,0,0]=4 2919 B10R1.176 Cc1cc(ccc1Cl)N[13CH3] 7a_100000187808_200025704644 [1,1,0,0,0,0|2,0,0]=4 2920 B10R1.176 Cc1cc(ccc1Cl)O[13CH3] 34a_100000211092_200025704644 [1,1,0,0,0,0|2,0,0]=4 2921 B10R1.176 Cc1cc(ccc1Cl)O[13CH3] 7a_100000211092_200025704644 [1,1,0,0,0,0|2,0,0]=4 2922 B10R1.176 Cc1cc(ccc1Cl)S[13CH3] 62a_100000049509_200025704644 [1,1,0,0,0,0|2,0,0]=4 2923 B10R1.176 Cc1cc(ccc1Cl)S[13CH3] 62a_200025704644_100000049509 [1,1,0,0,0,0|2,0,0]=4 2924 B10R1.176 Cc1cc(ccc1F)N[13CH3] 2230a_100000750164_200025704644 [1,1,0,0,0,0|2,0,0]=4 2925 B10R1.176 Cc1cc(ccc1F)N[13CH3] 34a_100000750164_200025704644 [1,1,0,0,0,0|2,0,0]=4 2926 B10R1.176 Cc1cc(ccc1F)N[13CH3] 7a_100000750164_200025704644 [1,1,0,0,0,0|2,0,0]=4 2927 B10R1.176 Cc1cc(ccc1F)O[13CH3] 34a_100000751312_200025704644 [1,1,0,0,0,0|2,0,0]=4 2928 B10R1.176 Cc1cc(ccc1F)O[13CH3] 7a_100000751312_200025704644 [1,1,0,0,0,0|2,0,0]=4 2929 B10R1.176 Cc1cc(ccc1F)S[13CH3] 62a_100011218330_200025704644 [1,1,0,0,0,0|2,0,0]=4 2930 B10R1.176 Cc1cc(ccc1F)S[13CH3] 62a_200025704644_100011218330 [1,1,0,0,0,0|2,0,0]=4 2931 B10R1.176 Cc1cc(ccc1I)N[13CH3] 34a_100000198070_200025704644 [1,1,0,0,0,0|2,0,0]=4 2932 B10R1.176 Cc1cc(ccc1I)N[13CH3] 7a_100000198070_200025704644 [1,1,0,0,0,0|2,0,0]=4 2933 B10R1.176 Cc1cc(ccc1I)O[13CH3] 34a_100000729255_200025704644 [1,1,0,0,0,0|2,0,0]=4 2934 B10R1.176 Cc1cc(ccc1I)O[13CH3] 7a_100000729255_200025704644 [1,1,0,0,0,0|2,0,0]=4 2935 B10R1.176 Cc1cc(ccc1N)O[13CH3] 34a_100000756630_200025704644 [1,1,0,0,0,0|2,0,0]=4 2936 B10R1.176 Cc1cc(ccc1N)O[13CH3] 7a_100000756630_200025704644 [1,1,0,0,0,0|2,0,0]=4 2937 B10R1.176 Cc1cc(ccc1N)S[13CH3] 62a_100000211769_200025704644 [1,1,0,0,0,0|2,0,0]=4 2938 B10R1.176 Cc1cc(ccc1N)S[13CH3] 62a_200025704644_100000211769 [1,1,0,0,0,0|2,0,0]=4 2939 B10R1.176 Cc1cc(ccc1O)C=O 271570a_203496583355_100000765772 [1,1,0,0,0,0|1,0,0]=3 2940 B10R1.176 Cc1cc(ccc1O)N[13CH3] 34a_100011218179_200025704644 [1,1,0,0,0,0|2,0,0]=4 2941 B10R1.176 Cc1cc(ccc1O)N[13CH3] 7a_100011218179_200025704644 [1,1,0,0,0,0|2,0,0]=4 2942 B10R1.176 Cc1cc(ccc1O)S[13CH3] 62a_200025704644_100000186361 [1,1,0,0,0,0|2,0,0]=4 2943 B10R1.176 Cc1cc(cnc1C)O[13CH3] 34a_100009854398_200025704644 [1,1,0,0,0,0|2,0,0]=4 2944 B10R1.176 Cc1cc(cnc1C)O[13CH3] 7a_100009854398_200025704644 [1,1,0,0,0,0|2,0,0]=4 2945 B10R1.176 Cc1cc(cnc1C)S[13CH3] 62a_100000697892_200025704644 [1,1,0,0,0,0|2,0,0]=4 2946 B10R1.176 Cc1cc(cnc1C)S[13CH3] 62a_200025704644_100000697892 [1,1,0,0,0,0|2,0,0]=4 2947 B10R1.176 Cc1cc(cnc1O)C=O 271570a_203496583355_100000070293 [1,1,0,0,0,0|2,0,0]=4 2948 B10R1.176 Cc1cc(ncc1O)C=O 271570a_203496583355_100009814806 [1,1,0,0,0,0|2,0,0]=4 2949 B10R1.176 Cc1ccc(c[n+]1[O-])S[13CH3] 62a_200025704644_100000703231 [1,1,0,0,0,0|2,0,0]=4 2950 B10R1.176 Cc1ccc(cc1Br)N[13CH3] 2230a_100000736455_200025704644 [1,1,0,0,0,0|1,0,0]=3 2951 B10R1.176 Cc1ccc(cc1Br)N[13CH3] 34a_100000736455_200025704644 [1,1,0,0,0,0|1,0,0]=3 2952 B10R1.176 Cc1ccc(cc1Br)N[13CH3] 7a_100000736455_200025704644 [1,1,0,0,0,0|1,0,0]=3 2953 B10R1.176 Cc1ccc(cc1Br)O[13CH3] 34a_100011380479_200025704644 [1,1,0,0,0,0|1,0,0]=3 2954 B10R1.176 Cc1ccc(cc1Br)O[13CH3] 7a_100011380479_200025704644 [1,1,0,0,0,0|1,0,0]=3 2955 B10R1.176 Cc1ccc(cc1Br)S[13CH3] 62a_100011847877_200025704644 [1,1,0,0,0,0|1,0,0]=3 2956 B10R1.176 Cc1ccc(cc1Br)S[13CH3] 62a_200025704644_100011847877 [1,1,0,0,0,0|1,0,0]=3 2957 B10R1.176 Cc1ccc(cc1C)N[13CH3] 2230a_100000724040_200025704644 [1,1,0,0,0,0|1,0,0]=3 2958 B10R1.176 Cc1ccc(cc1C)N[13CH3] 34a_100000724040_200025704644 [1,1,0,0,0,0|1,0,0]=3 2959 B10R1.176 Cc1ccc(cc1C)N[13CH3] 7a_100000724040_200025704644 [1,1,0,0,0,0|1,0,0]=3 2960 B10R1.176 Cc1ccc(cc1C)O[13CH3] 34a_100000210932_200025704644 [1,1,0,0,0,0|1,0,0]=3 2961 B10R1.176 Cc1ccc(cc1C)O[13CH3] 7a_100000210932_200025704644 [1,1,0,0,0,0|1,0,0]=3 2962 B10R1.176 Cc1ccc(cc1C)S[13CH3] 62a_100011215607_200025704644 [1,1,0,0,0,0|1,0,0]=3 2963 B10R1.176 Cc1ccc(cc1C)S[13CH3] 62a_200025704644_100011215607 [1,1,0,0,0,0|1,0,0]=3 2964 B10R1.176 Cc1ccc(cc1Cl)N[13CH3] 2230a_100000188892_200025704644 [1,1,0,0,0,0|1,0,0]=3 2965 B10R1.176 Cc1ccc(cc1Cl)N[13CH3] 34a_100000188892_200025704644 [1,1,0,0,0,0|1,0,0]=3 2966 B10R1.176 Cc1ccc(cc1Cl)N[13CH3] 7a_100000188892_200025704644 [1,1,0,0,0,0|1,0,0]=3 2967 B10R1.176 Cc1ccc(cc1Cl)O[13CH3] 34a_100011265682_200025704644 [1,1,0,0,0,0|1,0,0]=3 2968 B10R1.176 Cc1ccc(cc1Cl)O[13CH3] 7a_100011265682_200025704644 [1,1,0,0,0,0|1,0,0]=3 2969 B10R1.176 Cc1ccc(cc1Cl)S[13CH3] 62a_100011216363_200025704644 [1,1,0,0,0,0|1,0,0]=3 2970 B10R1.176 Cc1ccc(cc1Cl)S[13CH3] 62a_200025704644_100011216363 [1,1,0,0,0,0|1,0,0]=3 2971 B10R1.176 Cc1ccc(cc1F)N[13CH3] 2230a_100000210958_200025704644 [1,1,0,0,0,0|1,0,0]=3 2972 B10R1.176 Cc1ccc(cc1F)N[13CH3] 34a_100000210958_200025704644 [1,1,0,0,0,0|1,0,0]=3 2973 B10R1.176 Cc1ccc(cc1F)N[13CH3] 7a_100000210958_200025704644 [1,1,0,0,0,0|1,0,0]=3 2974 B10R1.176 Cc1ccc(cc1F)O[13CH3] 34a_100000722560_200025704644 [1,1,0,0,0,0|1,0,0]=3 2975 B10R1.176 Cc1ccc(cc1F)O[13CH3] 7a_100000722560_200025704644 [1,1,0,0,0,0|1,0,0]=3 2976 B10R1.176 Cc1ccc(cc1F)S[13CH3] 62a_100000720648_200025704644 [1,1,0,0,0,0|1,0,0]=3 2977 B10R1.176 Cc1ccc(cc1F)S[13CH3] 62a_200025704644_100000720648 [1,1,0,0,0,0|1,0,0]=3 2978 B10R1.176 Cc1ccc(cc1I)N[13CH3] 34a_100000184131_200025704644 [1,1,0,0,0,0|1,0,0]=3 2979 B10R1.176 Cc1ccc(cc1I)N[13CH3] 7a_100000184131_200025704644 [1,1,0,0,0,0|1,0,0]=3 2980 B10R1.176 Cc1ccc(cc1N)O[13CH3] 34a_100011216113_200025704644 [1,1,0,0,0,0|1,0,0]=3 2981 B10R1.176 Cc1ccc(cc1N)O[13CH3] 7a_100011216113_200025704644 [1,1,0,0,0,0|1,0,0]=3 2982 B10R1.176 Cc1ccc(cc1N)S[13CH3] 62a_100000761890_200025704644 [1,1,0,0,0,0|1,0,0]=3 2983 B10R1.176 Cc1ccc(cc1N)S[13CH3] 62a_200025704644_100000761890 [1,1,0,0,0,0|1,0,0]=3 2984 B10R1.176 Cc1ccc(cc1O)C#N 271570a_203496583355_100000690169 [1,1,0,0,0,0|1,0,1]=4 2985 B10R1.176 Cc1ccc(cc1O)C=O 271570a_203496583355_100000695567 [1,1,0,0,0,0|0,0,0]=2 2986 B10R1.176 Cc1ccc(cc1O)CO 271570a_203496583355_100000050133 [1,1,0,0,0,0|0,0,2]=4 2987 B10R1.176 Cc1ccc(cc1O)NN 271570a_203496583355_100016991967 [1,1,0,0,0,0|2,0,0]=4 2988 B10R1.176 Cc1ccc(cc1O)N[13CH3] 34a_100000759471_200025704644 [1,1,0,0,0,0|1,0,0]=3 2989 B10R1.176 Cc1ccc(cc1O)N[13CH3] 7a_100000759471_200025704644 [1,1,0,0,0,0|1,0,0]=3 2990 B10R1.176 Cc1ccc(cc1O)S[13CH3] 62a_100000685420_200025704644 [1,1,0,0,0,0|1,0,0]=3 2991 B10R1.176 Cc1ccc(cc1O)S[13CH3] 62a_200025704644_100000685420 [1,1,0,0,0,0|1,0,0]=3 2992 B10R1.176 Cc1ccc(nc1C)S[13CH3] 62a_100000103781_200025704644 [1,1,0,0,0,0|2,0,0]=4 2993 B10R1.176 Cc1ccc(nc1C)S[13CH3] 62a_200025704644_100000103781 [1,1,0,0,0,0|2,0,0]=4 2994 B10R1.176 Cc1ccc(nc1N)S[13CH3] 62a_100009857032_200025704644 [1,1,0,0,0,0|2,0,0]=4 2995 B10R1.176 Cc1ccc(nc1N)S[13CH3] 62a_200025704644_100009857032 [1,1,0,0,0,0|2,0,0]=4 2996 B10R1.176 Cc1cnc(cc1Br)O[13CH3] 34a_100009831917_200025704644 [1,1,0,0,0,0|2,0,0]=4 2997 B10R1.176 Cc1cnc(cc1C)S[13CH3] 62a_100009850809_200025704644 [1,1,0,0,0,0|2,0,0]=4 2998 B10R1.176 Cc1cnc(cc1C)S[13CH3] 62a_200025704644_100009850809 [1,1,0,0,0,0|2,0,0]=4 2999 B10R1.176 Cc1cnc(cc1F)S[13CH3] 62a_100009841206_200025704644 [1,1,0,0,0,0|2,0,0]=4 3000 B10R1.176 Cc1cnc(cc1F)S[13CH3] 62a_200025704644_100009841206 [1,1,0,0,0,0|2,0,0]=4 3001 B10R1.176 Cc1cnc(cc1N)S[13CH3] 62a_100000126663_200025704644 [1,1,0,0,0,0|2,0,0]=4 3002 B10R1.176 Cc1cnc(cc1N)S[13CH3] 62a_200025704644_100000126663 [1,1,0,0,0,0|2,0,0]=4 3003 B10R1.176 Cc1cnc(cc1O)C=O 271570a_203496583355_100010174032 [1,1,0,0,0,0|1,0,0]=3 3004 B10R1.176 Cc1cnc(cc1O)S[13CH3] 62a_100000704368_200025704644 [1,1,0,0,0,0|2,0,0]=4 3005 B10R1.176 Cc1cnc(cc1O)S[13CH3] 62a_200025704644_100000704368 [1,1,0,0,0,0|2,0,0]=4 3006 B10R1.176 Cc1nc(ccc1O)C=O 271570a_203496583355_100010238520 [1,1,0,0,0,0|2,0,0]=4 3007 B10R1.176 Cc1ncc(cc1Br)O[13CH3] 34a_100009819603_200025704644 [1,1,0,0,0,0|2,0,0]=4 3008 B10R1.176 Cc1ncc(cc1Br)O[13CH3] 7a_100009819603_200025704644 [1,1,0,0,0,0|2,0,0]=4 3009 B10R1.176 Cc1ncc(cc1F)S[13CH3] 62a_100009845756_200025704644 [1,1,0,0,0,0|2,0,0]=4 3010 B10R1.176 Cc1ncc(cc1F)S[13CH3] 62a_200025704644_100009845756 [1,1,0,0,0,0|2,0,0]=4 3011 B10R1.176 Cc1ncc(cc1N)S[13CH3] 62a_100011999542_200025704644 [1,1,0,0,0,0|2,0,0]=4 3012 B10R1.176 Cc1ncc(cc1N)S[13CH3] 62a_200025704644_100011999542 [1,1,0,0,0,0|2,0,0]=4 3013 B10R1.176 Cc1ncc(cc1O)S[13CH3] 62a_100009864810_200025704644 [1,1,0,0,0,0|2,0,0]=4 3014 B10R1.176 Cc1ncc(cc1O)S[13CH3] 62a_200025704644_100009864810 [1,1,0,0,0,0|2,0,0]=4 3015 B10R1.176 Cn1ccc(cc1=O)S[13CH3] 62a_100009820031_200025704644 [1,1,0,0,0,0|2,0,0]=4 3016 B10R1.176 Cn1ccc(cc1=O)S[13CH3] 62a_200025704644_100009820031 [1,1,0,0,0,0|2,0,0]=4 3017 B10R1.176 Nc1ncc(cc1O)C=O 271570a_203496583355_100010064899 [1,1,0,0,0,0|2,0,0]=4 3018 B10R1.176 O=Cc1ccc(c(c1)F)O 271570a_203496583355_100000686674 [1,1,0,0,0,0|1,0,0]=3 3019 B10R1.176 O=Cc1ccc(c(c1)O)Br 271570a_203496583355_100010146563 [1,1,0,0,0,0|1,0,0]=3 3020 B10R1.176 O=Cc1ccc(c(c1)O)Cl 271570a_203496583355_100010209939 [1,1,0,0,0,0|1,0,0]=3 3021 B10R1.176 O=Cc1ccc(c(c1)O)F 271570a_203496583355_100000211747 [1,1,0,0,0,0|1,0,0]=3 3022 B10R1.176 O=Cc1ccc(c(c1)O)O 271570a_203496583355_100000041418 [1,1,0,0,0,0|1,0,0]=3 3023 B10R1.176 O=Cc1ccc(c(c1)O)O 271570a_203496583355_100000184552 [1,1,0,0,0,0|1,0,0]=3 3024 B10R1.176 O=Cc1cnc(c(c1)F)O 271570a_203496583355_100009866847 [1,1,0,0,0,0|2,0,0]=4 3025 B10R1.176 O=Cc1cnc(c(c1)O)O 271570a_203496583355_100010064886 [1,1,0,0,0,0|2,0,0]=4 3026 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)Br 2230a_100011306057_200025704644 [1,1,0,0,0,0|2,0,0]=4 3027 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)Br 34a_100011306057_200025704644 [1,1,0,0,0,0|2,0,0]=4 3028 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)Br 7a_100011306057_200025704644 [1,1,0,0,0,0|2,0,0]=4 3029 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)Cl 2230a_100000686031_200025704644 [1,1,0,0,0,0|2,0,0]=4 3030 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)Cl 34a_100000686031_200025704644 [1,1,0,0,0,0|2,0,0]=4 3031 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)F 2230a_100000760356_200025704644 [1,1,0,0,0,0|2,0,0]=4 3032 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)F 34a_100000760356_200025704644 [1,1,0,0,0,0|2,0,0]=4 3033 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)F 7a_100000760356_200025704644 [1,1,0,0,0,0|2,0,0]=4 3034 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)I 34a_100000750458_200025704644 [1,1,0,0,0,0|2,0,0]=4 3035 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)O 34a_100011534360_200025704644 [1,1,0,0,0,0|2,0,0]=4 3036 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)Br 2230a_100000687081_200025704644 [1,1,0,0,0,0|2,0,0]=4 3037 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)Br 34a_100000687081_200025704644 [1,1,0,0,0,0|2,0,0]=4 3038 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)Br 7a_100000687081_200025704644 [1,1,0,0,0,0|2,0,0]=4 3039 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)Cl 2230a_100000184108_200025704644 [1,1,0,0,0,0|2,0,0]=4 3040 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)Cl 34a_100000184108_200025704644 [1,1,0,0,0,0|2,0,0]=4 3041 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)F 2230a_100000211060_200025704644 [1,1,0,0,0,0|2,0,0]=4 3042 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)F 34a_100000211060_200025704644 [1,1,0,0,0,0|2,0,0]=4 3043 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)F 7a_100000211060_200025704644 [1,1,0,0,0,0|2,0,0]=4 3044 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)I 34a_100000761885_200025704644 [1,1,0,0,0,0|2,0,0]=4 3045 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)O 34a_100000744943_200025704644 [1,1,0,0,0,0|2,0,0]=4 3046 B10R1.176 [13CH3]Nc1ccc(c(c1)F)Br 2230a_100000759894_200025704644 [1,1,0,0,0,0|2,0,0]=4 3047 B10R1.176 [13CH3]Nc1ccc(c(c1)F)Br 34a_100000759894_200025704644 [1,1,0,0,0,0|2,0,0]=4 3048 B10R1.176 [13CH3]Nc1ccc(c(c1)F)Br 7a_100000759894_200025704644 [1,1,0,0,0,0|2,0,0]=4 3049 B10R1.176 [13CH3]Nc1ccc(c(c1)F)Cl 2230a_100000739366_200025704644 [1,1,0,0,0,0|2,0,0]=4 3050 B10R1.176 [13CH3]Nc1ccc(c(c1)F)Cl 34a_100000739366_200025704644 [1,1,0,0,0,0|2,0,0]=4 3051 B10R1.176 [13CH3]Nc1ccc(c(c1)F)Cl 7a_100000739366_200025704644 [1,1,0,0,0,0|2,0,0]=4 3052 B10R1.176 [13CH3]Nc1ccc(c(c1)F)F 2230a_100000210724_200025704644 [1,1,0,0,0,0|2,0,0]=4 3053 B10R1.176 [13CH3]Nc1ccc(c(c1)F)F 34a_100000210724_200025704644 [1,1,0,0,0,0|2,0,0]=4 3054 B10R1.176 [13CH3]Nc1ccc(c(c1)F)F 7a_100000210724_200025704644 [1,1,0,0,0,0|2,0,0]=4 3055 B10R1.176 [13CH3]Nc1ccc(c(c1)F)I 34a_100011356925_200025704644 [1,1,0,0,0,0|2,0,0]=4 3056 B10R1.176 [13CH3]Nc1ccc(c(c1)F)I 7a_100011356925_200025704644 [1,1,0,0,0,0|2,0,0]=4 3057 B10R1.176 [13CH3]Nc1ccc(c(c1)F)O 34a_100011220035_200025704644 [1,1,0,0,0,0|2,0,0]=4 3058 B10R1.176 [13CH3]Nc1ccc(c(c1)F)O 7a_100011220035_200025704644 [1,1,0,0,0,0|2,0,0]=4 3059 B10R1.176 [13CH3]Nc1ccc(c(c1)I)Br 34a_100000750459_200025704644 [1,1,0,0,0,0|2,0,0]=4 3060 B10R1.176 [13CH3]Nc1ccc(c(c1)I)Cl 34a_100012360549_200025704644 [1,1,0,0,0,0|2,0,0]=4 3061 B10R1.176 [13CH3]Nc1ccc(c(c1)I)F 34a_114828291077_200025704644 [1,1,0,0,0,0|2,0,0]=4 3062 B10R1.176 [13CH3]Nc1ccc(c(c1)I)F 7a_114828291077_200025704644 [1,1,0,0,0,0|2,0,0]=4 3063 B10R1.176 [13CH3]Nc1ccc(c(c1)O)Cl 34a_100011934209_200025704644 [1,1,0,0,0,0|2,0,0]=4 3064 B10R1.176 [13CH3]Nc1ccc(c(c1)O)F 34a_100012017398_200025704644 [1,1,0,0,0,0|2,0,0]=4 3065 B10R1.176 [13CH3]Nc1ccc(c(c1)O)F 7a_100012017398_200025704644 [1,1,0,0,0,0|2,0,0]=4 3066 B10R1.176 [13CH3]Nc1ccc(c(c1)O)O 34a_100102946323_200025704644 [1,1,0,0,0,0|2,0,0]=4 3067 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)Cl 34a_100011933957_200025704644 [1,1,0,0,0,0|2,0,0]=4 3068 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)Cl 7a_100011933957_200025704644 [1,1,0,0,0,0|2,0,0]=4 3069 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)F 34a_100000693481_200025704644 [1,1,0,0,0,0|2,0,0]=4 3070 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)F 7a_100000693481_200025704644 [1,1,0,0,0,0|2,0,0]=4 3071 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)I 34a_100000701344_200025704644 [1,1,0,0,0,0|2,0,0]=4 3072 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)I 7a_100000701344_200025704644 [1,1,0,0,0,0|2,0,0]=4 3073 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)N 34a_100012001276_200025704644 [1,1,0,0,0,0|2,0,0]=4 3074 B10R1.176 [13CH3]Oc1ccc(c(c1)Br)N 7a_100012001276_200025704644 [1,1,0,0,0,0|2,0,0]=4 3075 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)Br 34a_100011215161_200025704644 [1,1,0,0,0,0|2,0,0]=4 3076 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)Br 7a_100011215161_200025704644 [1,1,0,0,0,0|2,0,0]=4 3077 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)Cl 34a_100000211054_200025704644 [1,1,0,0,0,0|2,0,0]=4 3078 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)Cl 7a_100000211054_200025704644 [1,1,0,0,0,0|2,0,0]=4 3079 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)F 34a_100000211030_200025704644 [1,1,0,0,0,0|2,0,0]=4 3080 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)F 7a_100000211030_200025704644 [1,1,0,0,0,0|2,0,0]=4 3081 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)I 34a_100000047559_200025704644 [1,1,0,0,0,0|2,0,0]=4 3082 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)I 7a_100000047559_200025704644 [1,1,0,0,0,0|2,0,0]=4 3083 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)N 34a_100011215599_200025704644 [1,1,0,0,0,0|2,0,0]=4 3084 B10R1.176 [13CH3]Oc1ccc(c(c1)Cl)N 7a_100011215599_200025704644 [1,1,0,0,0,0|2,0,0]=4 3085 B10R1.176 [13CH3]Oc1ccc(c(c1)F)Br 34a_100000755031_200025704644 [1,1,0,0,0,0|2,0,0]=4 3086 B10R1.176 [13CH3]Oc1ccc(c(c1)F)Br 7a_100000755031_200025704644 [1,1,0,0,0,0|2,0,0]=4 3087 B10R1.176 [13CH3]Oc1ccc(c(c1)F)Cl 34a_100000691581_200025704644 [1,1,0,0,0,0|2,0,0]=4 3088 B10R1.176 [13CH3]Oc1ccc(c(c1)F)Cl 7a_100000691581_200025704644 [1,1,0,0,0,0|2,0,0]=4 3089 B10R1.176 [13CH3]Oc1ccc(c(c1)F)F 34a_100000181275_200025704644 [1,1,0,0,0,0|2,0,0]=4 3090 B10R1.176 [13CH3]Oc1ccc(c(c1)F)F 7a_100000181275_200025704644 [1,1,0,0,0,0|2,0,0]=4 3091 B10R1.176 [13CH3]Oc1ccc(c(c1)F)I 34a_100009990212_200025704644 [1,1,0,0,0,0|2,0,0]=4 3092 B10R1.176 [13CH3]Oc1ccc(c(c1)F)I 7a_100009990212_200025704644 [1,1,0,0,0,0|2,0,0]=4 3093 B10R1.176 [13CH3]Oc1ccc(c(c1)F)N 34a_100000759473_200025704644 [1,1,0,0,0,0|2,0,0]=4 3094 B10R1.176 [13CH3]Oc1ccc(c(c1)F)N 7a_100000759473_200025704644 [1,1,0,0,0,0|2,0,0]=4 3095 B10R1.176 [13CH3]Oc1ccc(c(c1)I)Br 34a_100012339312_200025704644 [1,1,0,0,0,0|2,0,0]=4 3096 B10R1.176 [13CH3]Oc1ccc(c(c1)I)Br 7a_100012339312_200025704644 [1,1,0,0,0,0|2,0,0]=4 3097 B10R1.176 [13CH3]Oc1ccc(c(c1)I)Cl 34a_100000049588_200025704644 [1,1,0,0,0,0|2,0,0]=4 3098 B10R1.176 [13CH3]Oc1ccc(c(c1)I)Cl 7a_100000049588_200025704644 [1,1,0,0,0,0|2,0,0]=4 3099 B10R1.176 [13CH3]Oc1ccc(c(c1)I)N 34a_100010084370_200025704644 [1,1,0,0,0,0|2,0,0]=4 3100 B10R1.176 [13CH3]Oc1ccc(c(c1)I)N 7a_100010084370_200025704644 [1,1,0,0,0,0|2,0,0]=4 3101 B10R1.176 [13CH3]Oc1ccc(c(c1)N)Br 34a_100011999798_200025704644 [1,1,0,0,0,0|2,0,0]=4 3102 B10R1.176 [13CH3]Oc1ccc(c(c1)N)Br 7a_100011999798_200025704644 [1,1,0,0,0,0|2,0,0]=4 3103 B10R1.176 [13CH3]Oc1ccc(c(c1)N)Cl 34a_100011934297_200025704644 [1,1,0,0,0,0|2,0,0]=4 3104 B10R1.176 [13CH3]Oc1ccc(c(c1)N)F 34a_100012017239_200025704644 [1,1,0,0,0,0|2,0,0]=4 3105 B10R1.176 [13CH3]Oc1ccc(c(c1)N)F 7a_100012017239_200025704644 [1,1,0,0,0,0|2,0,0]=4 3106 B10R1.176 [13CH3]Oc1ccc(c(c1)N)N 34a_100025771000_200025704644 [1,1,0,0,0,0|2,0,0]=4 3107 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)Br 62a_100012356285_200025704644 [1,1,0,0,0,0|2,0,0]=4 3108 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)Br 62a_200025704644_100012356285 [1,1,0,0,0,0|2,0,0]=4 3109 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)Cl 62a_100012353702_200025704644 [1,1,0,0,0,0|2,0,0]=4 3110 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)Cl 62a_200025704644_100012353702 [1,1,0,0,0,0|2,0,0]=4 3111 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)F 62a_100012047266_200025704644 [1,1,0,0,0,0|2,0,0]=4 3112 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)F 62a_200025704644_100012047266 [1,1,0,0,0,0|2,0,0]=4 3113 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)N 62a_100000750455_200025704644 [1,1,0,0,0,0|2,0,0]=4 3114 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)N 62a_200025704644_100000750455 [1,1,0,0,0,0|2,0,0]=4 3115 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)O 62a_100012361655_200025704644 [1,1,0,0,0,0|2,0,0]=4 3116 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)O 62a_200025704644_100012361655 [1,1,0,0,0,0|2,0,0]=4 3117 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)Br 62a_100012047281_200025704644 [1,1,0,0,0,0|2,0,0]=4 3118 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)Br 62a_200025704644_100012047281 [1,1,0,0,0,0|2,0,0]=4 3119 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)Cl 62a_100011214914_200025704644 [1,1,0,0,0,0|2,0,0]=4 3120 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)Cl 62a_200025704644_100011214914 [1,1,0,0,0,0|2,0,0]=4 3121 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)F 62a_100011215976_200025704644 [1,1,0,0,0,0|2,0,0]=4 3122 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)F 62a_200025704644_100011215976 [1,1,0,0,0,0|2,0,0]=4 3123 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)N 62a_100011218065_200025704644 [1,1,0,0,0,0|2,0,0]=4 3124 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)N 62a_200025704644_100011218065 [1,1,0,0,0,0|2,0,0]=4 3125 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)O 62a_100012360047_200025704644 [1,1,0,0,0,0|2,0,0]=4 3126 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)O 62a_200025704644_100012360047 [1,1,0,0,0,0|2,0,0]=4 3127 B10R1.176 [13CH3]Sc1ccc(c(c1)F)Br 62a_100000685389_200025704644 [1,1,0,0,0,0|2,0,0]=4 3128 B10R1.176 [13CH3]Sc1ccc(c(c1)F)Br 62a_200025704644_100000685389 [1,1,0,0,0,0|2,0,0]=4 3129 B10R1.176 [13CH3]Sc1ccc(c(c1)F)Cl 62a_100011216805_200025704644 [1,1,0,0,0,0|2,0,0]=4 3130 B10R1.176 [13CH3]Sc1ccc(c(c1)F)Cl 62a_200025704644_100011216805 [1,1,0,0,0,0|2,0,0]=4 3131 B10R1.176 [13CH3]Sc1ccc(c(c1)F)F 62a_100000703953_200025704644 [1,1,0,0,0,0|2,0,0]=4 3132 B10R1.176 [13CH3]Sc1ccc(c(c1)F)F 62a_200025704644_100000703953 [1,1,0,0,0,0|2,0,0]=4 3133 B10R1.176 [13CH3]Sc1ccc(c(c1)F)N 62a_100011215594_200025704644 [1,1,0,0,0,0|2,0,0]=4 3134 B10R1.176 [13CH3]Sc1ccc(c(c1)F)N 62a_200025704644_100011215594 [1,1,0,0,0,0|2,0,0]=4 3135 B10R1.176 [13CH3]Sc1ccc(c(c1)F)O 62a_100000185481_200025704644 [1,1,0,0,0,0|2,0,0]=4 3136 B10R1.176 [13CH3]Sc1ccc(c(c1)F)O 62a_200025704644_100000185481 [1,1,0,0,0,0|2,0,0]=4 3137 B10R1.176 [13CH3]Sc1ccc(c(c1)N)Br 62a_100000750456_200025704644 [1,1,0,0,0,0|2,0,0]=4 3138 B10R1.176 [13CH3]Sc1ccc(c(c1)N)Br 62a_200025704644_100000750456 [1,1,0,0,0,0|2,0,0]=4 3139 B10R1.176 [13CH3]Sc1ccc(c(c1)N)Cl 62a_200000761891_200025704644 [1,1,0,0,0,0|2,0,0]=4 3140 B10R1.176 [13CH3]Sc1ccc(c(c1)N)Cl 62a_200025704644_200000761891 [1,1,0,0,0,0|2,0,0]=4 3141 B10R1.176 [13CH3]Sc1ccc(c(c1)N)F 62a_100000740924_200025704644 [1,1,0,0,0,0|2,0,0]=4 3142 B10R1.176 [13CH3]Sc1ccc(c(c1)N)F 62a_200025704644_100000740924 [1,1,0,0,0,0|2,0,0]=4 3143 B10R1.176 [13CH3]Sc1ccc(c(c1)N)N 62a_100000741789_200025704644 [1,1,0,0,0,0|2,0,0]=4 3144 B10R1.176 [13CH3]Sc1ccc(c(c1)N)N 62a_200025704644_100011534411 [1,1,0,0,0,0|2,0,0]=4 3145 B10R1.176 [13CH3]Sc1ccc(c(c1)N)O 62a_100000752626_200025704644 [1,1,0,0,0,0|2,0,0]=4 3146 B10R1.176 [13CH3]Sc1ccc(c(c1)N)O 62a_200025704644_100000752626 [1,1,0,0,0,0|2,0,0]=4 3147 B10R1.176 [13CH3]Sc1ccc(c(c1)O)Br 62a_100012356990_200025704644 [1,1,0,0,0,0|2,0,0]=4 3148 B10R1.176 [13CH3]Sc1ccc(c(c1)O)Br 62a_200025704644_100012356990 [1,1,0,0,0,0|2,0,0]=4 3149 B10R1.176 [13CH3]Sc1ccc(c(c1)O)Cl 62a_100011356854_200025704644 [1,1,0,0,0,0|2,0,0]=4 3150 B10R1.176 [13CH3]Sc1ccc(c(c1)O)Cl 62a_200025704644_100011356854 [1,1,0,0,0,0|2,0,0]=4 3151 B10R1.176 [13CH3]Sc1ccc(c(c1)O)F 62a_100000686035_200025704644 [1,1,0,0,0,0|2,0,0]=4 3152 B10R1.176 [13CH3]Sc1ccc(c(c1)O)F 62a_200025704644_100000686035 [1,1,0,0,0,0|2,0,0]=4 3153 B10R1.176 [13CH3]Sc1ccc(c(c1)O)N 62a_100000739049_200025704644 [1,1,0,0,0,0|2,0,0]=4 3154 B10R1.176 [13CH3]Sc1ccc(c(c1)O)N 62a_200025704644_100000739049 [1,1,0,0,0,0|2,0,0]=4 3155 B10R1.176 [13CH3]Sc1ccc(c(c1)O)O 62a_200025704644_100009813601 [1,1,0,0,0,0|2,0,0]=4 3156 B10R1.15 CC(S[13CH3])c1ccccc1 62a_100000230085_200025704644 [1,1,0,0,0,0|0,1,1]=4 3157 B10R1.15 CC(S[13CH3])c1ccccc1 62a_200025704644_100000230085 [1,1,0,0,0,0|0,1,1]=4 3158 B10R1.15 CCC(=O)c1ccccc1 1458a_100000185807_100000210202 [1,1,0,0,0,0|0,0,0]=2 3159 B10R1.15 CCN(C)c1ccccc1 2230a_100000210012_100000210202 [1,1,0,0,0,0|2,0,0]=4 3160 B10R1.15 CCN(C)c1ccccc1 2230a_100000210013_200000210301 [1,1,0,0,0,0|2,0,0]=4 3161 B10R1.15 CCN(C)c1ccccc1 269982a_100000210012_100000204670 [1,1,0,0,0,0|2,0,0]=4 3162 B10R1.15 CCN(C)c1ccccc1 269982a_100000210013_200000210301 [1,1,0,0,0,0|2,0,0]=4 3163 B10R1.15 CCN(C)c1ccccc1 34a_100000210012_100000210202 [1,1,0,0,0,0|2,0,0]=4 3164 B10R1.15 CCN(C)c1ccccc1 34a_100000210013_200000210301 [1,1,0,0,0,0|2,0,0]=4 3165 B10R1.15 CCN([13CH3])c1ccccc1 2230a_100000210013_200025704644 [1,1,0,0,0,0|2,0,0]=4 3166 B10R1.15 CCN([13CH3])c1ccccc1 269982a_100000210013_200025704644 [1,1,0,0,0,0|2,0,0]=4 3167 B10R1.15 CCN([13CH3])c1ccccc1 34a_100000210013_200025704644 [1,1,0,0,0,0|2,0,0]=4 3168 B10R1.15 CN(CF)c1ccccc1 269982a_100000210012_100015361967 [1,1,0,0,0,0|2,0,0]=4 3169 B10R1.15 CN(CF)c1ccccc1 34a_100000210012_100015361967 [1,1,0,0,0,0|2,0,0]=4 3170 B10R1.15 CNC(=O)c1ccccc1 11a_106832991635_100000185807 [1,1,0,0,0,0|0,0,0]=2 3171 B10R1.15 CNC(=O)c1ccccc1 1626a_100102657272_100000185807 [1,1,0,0,0,0|0,0,0]=2 3172 B10R1.15 CNC(=O)c1ccccc1 240690a_100102657272_100000185807 [1,1,0,0,0,0|0,0,0]=2 3173 B10R1.15 CNC(=O)c1ccccc1 527a_100102657272_100000185807 [1,1,0,0,0,0|0,0,0]=2 3174 B10R1.15 CNC(C)c1ccccc1 2230a_106832991635_100000230085 [1,1,0,0,0,0|1,0,1]=4 3175 B10R1.15 CNC(C)c1ccccc1 269862a_106832991636_100000185851 [1,1,0,0,0,0|1,0,1]=4 3176 B10R1.15 CNC(C)c1ccccc1 34a_100102657272_100000211855 [1,1,0,0,0,0|1,0,1]=4 3177 B10R1.15 CNC(C)c1ccccc1 7a_106832991635_100000230085 [1,1,0,0,0,0|1,0,1]=4 3178 B10R1.15 CN[C@H](C)c1ccccc1 2230a_100000751104_200000210301 [1,1,0,0,0,0|1,0,1]=4 3179 B10R1.15 COC(C)c1ccccc1 34a_100138415774_100000211855 [1,1,0,0,0,0|0,0,2]=4 3180 B10R1.15 CO[C@H](C)c1ccccc1 34a_100000761318_200000210301 [1,1,0,0,0,0|0,0,2]=4 3181 B10R1.15 CO[C@H](C)c1ccccc1 7a_100000761318_200000210301 [1,1,0,0,0,0|0,0,2]=4 3182 B10R1.15 CSC(C)c1ccccc1 62a_100000230085_200000210301 [1,1,0,0,0,0|0,1,1]=4 3183 B10R1.15 CSC(C)c1ccccc1 62a_200000210301_100000230085 [1,1,0,0,0,0|0,1,1]=4 3184 B10R1.15 C[C@@H](N[13CH3])c1ccccc1 2230a_100000751104_200025704644 [1,1,0,0,0,0|1,0,1]=4 3185 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 34a_100000761318_200025704644 [1,1,0,0,0,0|0,0,2]=4 3186 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 7a_100000761318_200025704644 [1,1,0,0,0,0|0,0,2]=4 3187 B10R1.15 O=C(CF)c1ccccc1 1458a_100000185807_100015361967 [1,1,0,0,0,0|0,0,0]=2 3188 B10R1.61 C=C(C)c1c[nH]ccc1=O 271570a_100000694244_100009998708 [1,1,0,0,0,0|2,0,0]=4 3189 B10R1.61 C=C(C)c1c[nH]ccc1=S 271570a_100000694244_200012280681 [1,1,0,0,0,0|2,0,0]=4 3190 B10R1.61 C=C(C)c1ccc[nH]c1=O 271570a_100000694244_100000050042 [1,1,0,0,0,0|2,0,0]=4 3191 B10R1.61 C=C(C)c1cccc[n+]1C 271570a_100000694244_100000212160 [1,1,0,0,0,0|2,0,0]=4 3192 B10R1.61 C=C(C)c1cccc[n+]1[O-] 271570a_100000694244_200000042595 [1,1,0,0,0,0|2,0,0]=4 3193 B10R1.61 C=C(C)c1ccccc1Br 271570a_100000694244_100000695589 [1,1,0,0,0,0|1,0,0]=3 3194 B10R1.61 C=C(C)c1ccccc1C 271570a_100000694244_100000210755 [1,1,0,0,0,0|1,0,0]=3 3195 B10R1.61 C=C(C)c1ccccc1Cl 271570a_100000694244_100000764095 [1,1,0,0,0,0|1,0,0]=3 3196 B10R1.61 C=C(C)c1ccccc1F 271570a_100000694244_100011215700 [1,1,0,0,0,0|1,0,0]=3 3197 B10R1.61 C=C(C)c1ccccc1N 271570a_100000694244_100000210017 [1,1,0,0,0,0|1,0,0]=3 3198 B10R1.61 C=C(C)c1ccccc1O 271570a_100000694244_100000739446 [1,1,0,0,0,0|1,0,0]=3 3199 B10R1.61 C=C(C)c1cccnc1Br 271570a_100000694244_100010202626 [1,1,0,0,0,0|2,0,0]=4 3200 B10R1.61 C=C(C)c1cccnc1C 271570a_100000694244_100000751574 [1,1,0,0,0,0|2,0,0]=4 3201 B10R1.61 C=C(C)c1cccnc1Cl 271570a_100000694244_100000036424 [1,1,0,0,0,0|2,0,0]=4 3202 B10R1.61 C=C(C)c1cccnc1F 271570a_100000694244_100009816115 [1,1,0,0,0,0|2,0,0]=4 3203 B10R1.61 C=C(C)c1cccnc1N 271570a_100000694244_100000045569 [1,1,0,0,0,0|2,0,0]=4 3204 B10R1.61 C=C(C)c1ccncc1Br 271570a_100000694244_100000726257 [1,1,0,0,0,0|2,0,0]=4 3205 B10R1.61 C=C(C)c1ccncc1C 271570a_100000694244_100015191297 [1,1,0,0,0,0|2,0,0]=4 3206 B10R1.61 C=C(C)c1ccncc1Cl 271570a_100000694244_100000708259 [1,1,0,0,0,0|2,0,0]=4 3207 B10R1.61 C=C(C)c1ccncc1F 271570a_100000694244_100000047030 [1,1,0,0,0,0|2,0,0]=4 3208 B10R1.61 C=C(C)c1ccncc1N 271570a_100000694244_100009815883 [1,1,0,0,0,0|2,0,0]=4 3209 B10R1.61 C=C(C)c1ccncc1O 271570a_100000694244_100009817591 [1,1,0,0,0,0|2,0,0]=4 3210 B10R1.61 C=C(C)c1cnccc1Br 271570a_100000694244_100010138639 [1,1,0,0,0,0|2,0,0]=4 3211 B10R1.61 C=C(C)c1cnccc1C 271570a_100000694244_100000761580 [1,1,0,0,0,0|2,0,0]=4 3212 B10R1.61 C=C(C)c1cnccc1Cl 271570a_100000694244_100009995489 [1,1,0,0,0,0|2,0,0]=4 3213 B10R1.61 C=C(C)c1cnccc1F 271570a_100000694244_100009820683 [1,1,0,0,0,0|2,0,0]=4 3214 B10R1.61 C=C(C)c1cnccc1N 271570a_100000694244_100000047001 [1,1,0,0,0,0|2,0,0]=4 3215 B10R1.61 C=C(C)c1ncccc1Br 271570a_100000694244_100000696092 [1,1,0,0,0,0|2,0,0]=4 3216 B10R1.61 C=C(C)c1ncccc1C 271570a_100000694244_100000751373 [1,1,0,0,0,0|2,0,0]=4 3217 B10R1.61 C=C(C)c1ncccc1Cl 271570a_100000694244_100011356963 [1,1,0,0,0,0|2,0,0]=4 3218 B10R1.61 C=C(C)c1ncccc1F 271570a_100000694244_100000685392 [1,1,0,0,0,0|2,0,0]=4 3219 B10R1.61 C=C(C)c1ncccc1N 271570a_100000694244_100000688686 [1,1,0,0,0,0|2,0,0]=4 3220 B10R1.61 C=C(C)c1ncccc1O 271570a_100000694244_100000034122 [1,1,0,0,0,0|2,0,0]=4 3221 B10R1.61 CC(=O)c1ccccc1Br 1458a_100000188424_200000210301 [1,1,0,0,0,0|0,0,0]=2 3222 B10R1.61 CC(=O)c1ccccc1C 1458a_100000212026_200000210301 [1,1,0,0,0,0|0,0,0]=2 3223 B10R1.61 CC(=O)c1ccccc1Cl 1458a_100000185844_200000210301 [1,1,0,0,0,0|0,0,0]=2 3224 B10R1.61 CC(=O)c1ccccc1F 1458a_100000188656_200000210301 [1,1,0,0,0,0|0,0,0]=2 3225 B10R1.61 CC(=O)c1ccccc1I 1458a_100000187884_200000210301 [1,1,0,0,0,0|0,0,0]=2 3226 B10R1.61 CC(=O)c1ccccc1O 1458a_100015234032_200000210301 [1,1,0,0,0,0|0,0,0]=2 3227 B10R1.61 CC(=O)c1ccccc1O 271570a_203496583355_100000751169 [1,1,0,0,0,0|0,0,0]=2 3228 B10R1.61 CC(=O)c1ccccc1[O-] 1458a_100009911694_200000210301 [1,1,0,0,0,0|0,0,0]=2 3229 B10R1.61 CC(=O)c1cccnc1O 271570a_203496583355_100000753718 [1,1,0,0,0,0|1,0,0]=3 3230 B10R1.61 CC(=O)c1ccncc1O 271570a_203496583355_100009993184 [1,1,0,0,0,0|1,0,0]=3 3231 B10R1.61 CC(=O)c1cnccc1O 271570a_203496583355_100160469449 [1,1,0,0,0,0|1,0,0]=3 3232 B10R1.61 CC(=O)c1ncccc1O 271570a_203496583355_100012348690 [1,1,0,0,0,0|1,0,0]=3 3233 B10R1.61 CC(=O)c1nccnc1O 271570a_203496583355_100000099859 [1,1,0,0,0,0|2,0,0]=4 3234 B10R1.61 CC(C)c1ccccc1O 271570a_203496583355_100011218076 [1,1,0,0,0,0|1,0,1]=4 3235 B10R1.61 CC(N)c1ccccc1O 271570a_203496583355_100000181357 [1,1,0,0,0,0|1,0,1]=4 3236 B10R1.61 CC(O)c1ccccc1O 271570a_203496583355_100000702211 [1,1,0,0,0,0|0,0,2]=4 3237 B10R1.61 CN(C)c1ccccc1Br 2230a_100020606079_200000210301 [1,1,0,0,0,0|2,0,0]=4 3238 B10R1.61 CN(C)c1ccccc1Br 269982a_100020606079_200000210301 [1,1,0,0,0,0|2,0,0]=4 3239 B10R1.61 CN(C)c1ccccc1Br 34a_100020606079_200000210301 [1,1,0,0,0,0|2,0,0]=4 3240 B10R1.61 CN(C)c1ccccc1Cl 2230a_100000219374_200000210301 [1,1,0,0,0,0|2,0,0]=4 3241 B10R1.61 CN(C)c1ccccc1Cl 269982a_100000219374_200000210301 [1,1,0,0,0,0|2,0,0]=4 3242 B10R1.61 CN(C)c1ccccc1Cl 34a_100000219374_200000210301 [1,1,0,0,0,0|2,0,0]=4 3243 B10R1.61 CN(C)c1ccccc1F 2230a_100000220357_200000210301 [1,1,0,0,0,0|2,0,0]=4 3244 B10R1.61 CN(C)c1ccccc1F 269982a_100000220357_200000210301 [1,1,0,0,0,0|2,0,0]=4 3245 B10R1.61 CN(C)c1ccccc1F 34a_100000220357_200000210301 [1,1,0,0,0,0|2,0,0]=4 3246 B10R1.61 CN(C)c1ccccc1F 38a_100000220357_200000210301 [1,1,0,0,0,0|2,0,0]=4 3247 B10R1.61 CN(C)c1ccccc1O 269982a_100000033821_200000210301 [1,1,0,0,0,0|2,0,0]=4 3248 B10R1.61 CN(C)c1ccccc1O 271570a_203496583355_100011290883 [1,1,0,0,0,0|2,0,0]=4 3249 B10R1.61 CN([13CH3])c1ccccc1Br 2230a_100020606079_200025704644 [1,1,0,0,0,0|2,0,0]=4 3250 B10R1.61 CN([13CH3])c1ccccc1Br 269982a_100020606079_200025704644 [1,1,0,0,0,0|2,0,0]=4 3251 B10R1.61 CN([13CH3])c1ccccc1Br 34a_100020606079_200025704644 [1,1,0,0,0,0|2,0,0]=4 3252 B10R1.61 CN([13CH3])c1ccccc1Cl 2230a_100000219374_200025704644 [1,1,0,0,0,0|2,0,0]=4 3253 B10R1.61 CN([13CH3])c1ccccc1Cl 269982a_100000219374_200025704644 [1,1,0,0,0,0|2,0,0]=4 3254 B10R1.61 CN([13CH3])c1ccccc1Cl 34a_100000219374_200025704644 [1,1,0,0,0,0|2,0,0]=4 3255 B10R1.61 CN([13CH3])c1ccccc1F 2230a_100000220357_200025704644 [1,1,0,0,0,0|2,0,0]=4 3256 B10R1.61 CN([13CH3])c1ccccc1F 269982a_100000220357_200025704644 [1,1,0,0,0,0|2,0,0]=4 3257 B10R1.61 CN([13CH3])c1ccccc1F 34a_100000220357_200025704644 [1,1,0,0,0,0|2,0,0]=4 3258 B10R1.61 CN([13CH3])c1ccccc1F 38a_100000220357_200025704644 [1,1,0,0,0,0|2,0,0]=4 3259 B10R1.61 CN([13CH3])c1ccccc1O 269982a_100000033821_200025704644 [1,1,0,0,0,0|2,0,0]=4 3260 B10R1.61 CS(=O)c1ccccc1O 271570a_203496583355_100000734199 [1,1,0,0,0,0|1,0,0]=3 3261 B10R1.61 Cc1ccccc1C(=O)[13CH3] 1458a_100000212026_200025704644 [1,1,0,0,0,0|0,0,0]=2 3262 B10R1.61 Cc1ccccc1N(C)C 2230a_100000219699_200000210301 [1,1,0,0,0,0|2,0,0]=4 3263 B10R1.61 Cc1ccccc1N(C)C 269982a_100000219699_200000210301 [1,1,0,0,0,0|2,0,0]=4 3264 B10R1.61 Cc1ccccc1N(C)C 34a_100000219699_200000210301 [1,1,0,0,0,0|2,0,0]=4 3265 B10R1.61 Cc1ccccc1N(C)[13CH3] 2230a_100000219699_200025704644 [1,1,0,0,0,0|2,0,0]=4 3266 B10R1.61 Cc1ccccc1N(C)[13CH3] 269982a_100000219699_200025704644 [1,1,0,0,0,0|2,0,0]=4 3267 B10R1.61 Cc1ccccc1N(C)[13CH3] 34a_100000219699_200025704644 [1,1,0,0,0,0|2,0,0]=4 3268 B10R1.61 NC(=O)c1ccccc1O 271570a_203496583355_100000162227 [1,1,0,0,0,0|1,0,0]=3 3269 B10R1.61 NC(=O)c1cccnc1O 271570a_203496583355_100000162199 [1,1,0,0,0,0|2,0,0]=4 3270 B10R1.61 NC(=O)c1ccncc1O 271570a_203496583355_100010205435 [1,1,0,0,0,0|2,0,0]=4 3271 B10R1.61 NC(=O)c1cnccc1O 271570a_203496583355_100000697804 [1,1,0,0,0,0|2,0,0]=4 3272 B10R1.61 NC(=O)c1ncccc1O 271570a_203496583355_200012359670 [1,1,0,0,0,0|2,0,0]=4 3273 B10R1.61 [13CH3]C(=O)c1ccccc1Br 1458a_100000188424_200025704644 [1,1,0,0,0,0|0,0,0]=2 3274 B10R1.61 [13CH3]C(=O)c1ccccc1Cl 1458a_100000185844_200025704644 [1,1,0,0,0,0|0,0,0]=2 3275 B10R1.61 [13CH3]C(=O)c1ccccc1F 1458a_100000188656_200025704644 [1,1,0,0,0,0|0,0,0]=2 3276 B10R1.61 [13CH3]C(=O)c1ccccc1I 1458a_100000187884_200025704644 [1,1,0,0,0,0|0,0,0]=2 3277 B10R1.61 [13CH3]C(=O)c1ccccc1O 1458a_100015234032_200025704644 [1,1,0,0,0,0|0,0,0]=2 3278 B10R1.61 [13CH3]C(=O)c1ccccc1[O-] 1458a_100009911694_200025704644 [1,1,0,0,0,0|0,0,0]=2 3279 B10R1.113 C=C(C)c1cc(ccn1)C 271570a_100000694244_100000750283 [1,1,0,0,0,0|2,0,0]=4 3280 B10R1.113 C=C(C)c1cc(ccn1)Cl 271570a_100000694244_100010167805 [1,1,0,0,0,0|2,0,0]=4 3281 B10R1.113 C=C(C)c1cc(ccn1)F 271570a_100000694244_100009817058 [1,1,0,0,0,0|2,0,0]=4 3282 B10R1.113 C=C(C)c1cc(ccn1)N 271570a_100000694244_100009814236 [1,1,0,0,0,0|2,0,0]=4 3283 B10R1.113 C=C(C)c1cc(ccn1)O 271570a_100000694244_100000762945 [1,1,0,0,0,0|2,0,0]=4 3284 B10R1.113 C=C(C)c1cc[nH]c(=O)c1 271570a_100000694244_100009816521 [1,1,0,0,0,0|2,0,0]=4 3285 B10R1.113 C=C(C)c1ccc[n+](c1)C 271570a_100000694244_100009996589 [1,1,0,0,0,0|2,0,0]=4 3286 B10R1.113 C=C(C)c1ccc[n+](c1)[O-] 271570a_100000694244_100009815978 [1,1,0,0,0,0|2,0,0]=4 3287 B10R1.113 C=C(C)c1cccc(=O)[nH]1 271570a_100000694244_100000761760 [1,1,0,0,0,0|2,0,0]=4 3288 B10R1.113 C=C(C)c1cccc(c1)Br 271570a_100000694244_100000691529 [1,1,0,0,0,0|1,0,0]=3 3289 B10R1.113 C=C(C)c1cccc(c1)C 271570a_100000694244_100011215228 [1,1,0,0,0,0|1,0,0]=3 3290 B10R1.113 C=C(C)c1cccc(c1)Cl 271570a_100000694244_100000699651 [1,1,0,0,0,0|1,0,0]=3 3291 B10R1.113 C=C(C)c1cccc(c1)F 271570a_100000694244_100000685547 [1,1,0,0,0,0|1,0,0]=3 3292 B10R1.113 C=C(C)c1cccc(c1)N 271570a_100000694244_100000210019 [1,1,0,0,0,0|1,0,0]=3 3293 B10R1.113 C=C(C)c1cccc(c1)O 271570a_100000694244_100000211634 [1,1,0,0,0,0|1,0,0]=3 3294 B10R1.113 C=C(C)c1cccc(c1)O 271570a_203496583355_100012123953 [1,1,0,0,0,0|1,0,0]=3 3295 B10R1.113 C=C(C)c1cccc(c1)[S] 271570a_100000694244_114929384022 [1,1,0,0,0,0|1,0,0]=3 3296 B10R1.113 C=C(C)c1cccc(n1)Br 271570a_100000694244_100000684672 [1,1,0,0,0,0|2,0,0]=4 3297 B10R1.113 C=C(C)c1cccc(n1)C 271570a_100000694244_100000742759 [1,1,0,0,0,0|2,0,0]=4 3298 B10R1.113 C=C(C)c1cccc(n1)F 271570a_100000694244_100009815982 [1,1,0,0,0,0|2,0,0]=4 3299 B10R1.113 C=C(C)c1cccc(n1)N 271570a_100000694244_100000740741 [1,1,0,0,0,0|2,0,0]=4 3300 B10R1.113 C=C(C)c1ccnc(c1)Br 271570a_100000694244_100009814637 [1,1,0,0,0,0|2,0,0]=4 3301 B10R1.113 C=C(C)c1ccnc(c1)C 271570a_100000694244_100000758586 [1,1,0,0,0,0|2,0,0]=4 3302 B10R1.113 C=C(C)c1ccnc(c1)Cl 271570a_100000694244_100000035001 [1,1,0,0,0,0|2,0,0]=4 3303 B10R1.113 C=C(C)c1ccnc(c1)F 271570a_100000694244_100009816116 [1,1,0,0,0,0|2,0,0]=4 3304 B10R1.113 C=C(C)c1ccnc(c1)N 271570a_100000694244_100000744379 [1,1,0,0,0,0|2,0,0]=4 3305 B10R1.113 C=C(C)c1cncc(c1)Br 271570a_100000694244_100000728054 [1,1,0,0,0,0|2,0,0]=4 3306 B10R1.113 C=C(C)c1cncc(c1)C 271570a_100000694244_100000760492 [1,1,0,0,0,0|2,0,0]=4 3307 B10R1.113 C=C(C)c1cncc(c1)Cl 271570a_100000694244_100000049639 [1,1,0,0,0,0|2,0,0]=4 3308 B10R1.113 C=C(C)c1cncc(c1)F 271570a_100000694244_100000744099 [1,1,0,0,0,0|2,0,0]=4 3309 B10R1.113 C=C(C)c1cncc(c1)N 271570a_100000694244_100000687067 [1,1,0,0,0,0|2,0,0]=4 3310 B10R1.113 C=C(C)c1cncc(c1)O 271570a_100000694244_100000754920 [1,1,0,0,0,0|2,0,0]=4 3311 B10R1.113 C=C(C)c1cncc(c1)O 271570a_203496583355_200009889500 [1,1,0,0,0,0|2,0,0]=4 3312 B10R1.113 CC(=O)c1cc(ccn1)O 271570a_203496583355_100000709912 [1,1,0,0,0,0|1,0,0]=3 3313 B10R1.113 CC(=O)c1cccc(c1)Br 1458a_100000210664_200000210301 [1,1,0,0,0,0|0,0,0]=2 3314 B10R1.113 CC(=O)c1cccc(c1)C 1458a_100000189346_200000210301 [1,1,0,0,0,0|0,0,0]=2 3315 B10R1.113 CC(=O)c1cccc(c1)Cl 1458a_100000210390_200000210301 [1,1,0,0,0,0|0,0,0]=2 3316 B10R1.113 CC(=O)c1cccc(c1)F 1458a_100000210950_200000210301 [1,1,0,0,0,0|0,0,0]=2 3317 B10R1.113 CC(=O)c1cccc(c1)I 1458a_100000184098_200000210301 [1,1,0,0,0,0|0,0,0]=2 3318 B10R1.113 CC(=O)c1cccc(c1)O 1458a_100000183914_200000210301 [1,1,0,0,0,0|0,0,0]=2 3319 B10R1.113 CC(=O)c1cccc(c1)O 271570a_203496583355_100000210093 [1,1,0,0,0,0|0,0,0]=2 3320 B10R1.113 CC(=O)c1cccc(n1)O 271570a_203496583355_100009816502 [1,1,0,0,0,0|1,0,0]=3 3321 B10R1.113 CC(=O)c1ccnc(c1)O 271570a_203496583355_100000685609 [1,1,0,0,0,0|1,0,0]=3 3322 B10R1.113 CC(=O)c1ccnc(n1)O 271570a_203496583355_100010643186 [1,1,0,0,0,0|2,0,0]=4 3323 B10R1.113 CC(=O)c1cncc(c1)O 271570a_203496583355_100011216243 [1,1,0,0,0,0|1,0,0]=3 3324 B10R1.113 CC(C)c1cccc(c1)O 271570a_203496583355_100011214899 [1,1,0,0,0,0|1,0,1]=4 3325 B10R1.113 CC(N)c1cccc(c1)O 271570a_203496583355_100020642005 [1,1,0,0,0,0|1,0,1]=4 3326 B10R1.113 CC(O)c1cccc(c1)O 271570a_203496583355_100000246457 [1,1,0,0,0,0|0,0,2]=4 3327 B10R1.113 CN(C)c1cccc(c1)Br 2230a_100000219648_200000210301 [1,1,0,0,0,0|2,0,0]=4 3328 B10R1.113 CN(C)c1cccc(c1)Br 269982a_100000219648_200000210301 [1,1,0,0,0,0|2,0,0]=4 3329 B10R1.113 CN(C)c1cccc(c1)Br 34a_100000219648_200000210301 [1,1,0,0,0,0|2,0,0]=4 3330 B10R1.113 CN(C)c1cccc(c1)Cl 2230a_100000220044_200000210301 [1,1,0,0,0,0|2,0,0]=4 3331 B10R1.113 CN(C)c1cccc(c1)Cl 269982a_100000220044_200000210301 [1,1,0,0,0,0|2,0,0]=4 3332 B10R1.113 CN(C)c1cccc(c1)Cl 34a_100000220044_200000210301 [1,1,0,0,0,0|2,0,0]=4 3333 B10R1.113 CN(C)c1cccc(c1)F 2230a_100020633736_200000210301 [1,1,0,0,0,0|2,0,0]=4 3334 B10R1.113 CN(C)c1cccc(c1)F 269982a_100020633736_200000210301 [1,1,0,0,0,0|2,0,0]=4 3335 B10R1.113 CN(C)c1cccc(c1)F 34a_100020633736_200000210301 [1,1,0,0,0,0|2,0,0]=4 3336 B10R1.113 CN(C)c1cccc(c1)I 2230a_100000221217_200000210301 [1,1,0,0,0,0|2,0,0]=4 3337 B10R1.113 CN(C)c1cccc(c1)I 269982a_100000221217_200000210301 [1,1,0,0,0,0|2,0,0]=4 3338 B10R1.113 CN(C)c1cccc(c1)I 34a_100000221217_200000210301 [1,1,0,0,0,0|2,0,0]=4 3339 B10R1.113 CN(C)c1cccc(c1)O 2230a_100000756613_200000210301 [1,1,0,0,0,0|2,0,0]=4 3340 B10R1.113 CN(C)c1cccc(c1)O 269982a_100000756613_200000210301 [1,1,0,0,0,0|2,0,0]=4 3341 B10R1.113 CN(C)c1cccc(c1)O 271570a_203496583355_100011215952 [1,1,0,0,0,0|2,0,0]=4 3342 B10R1.113 CN(C)c1cccc(c1)O 34a_100000756613_200000210301 [1,1,0,0,0,0|2,0,0]=4 3343 B10R1.113 CN([13CH3])c1cccc(c1)Br 2230a_100000219648_200025704644 [1,1,0,0,0,0|2,0,0]=4 3344 B10R1.113 CN([13CH3])c1cccc(c1)Br 269982a_100000219648_200025704644 [1,1,0,0,0,0|2,0,0]=4 3345 B10R1.113 CN([13CH3])c1cccc(c1)Br 34a_100000219648_200025704644 [1,1,0,0,0,0|2,0,0]=4 3346 B10R1.113 CN([13CH3])c1cccc(c1)Cl 2230a_100000220044_200025704644 [1,1,0,0,0,0|2,0,0]=4 3347 B10R1.113 CN([13CH3])c1cccc(c1)Cl 269982a_100000220044_200025704644 [1,1,0,0,0,0|2,0,0]=4 3348 B10R1.113 CN([13CH3])c1cccc(c1)Cl 34a_100000220044_200025704644 [1,1,0,0,0,0|2,0,0]=4 3349 B10R1.113 CN([13CH3])c1cccc(c1)F 2230a_100020633736_200025704644 [1,1,0,0,0,0|2,0,0]=4 3350 B10R1.113 CN([13CH3])c1cccc(c1)F 269982a_100020633736_200025704644 [1,1,0,0,0,0|2,0,0]=4 3351 B10R1.113 CN([13CH3])c1cccc(c1)F 34a_100020633736_200025704644 [1,1,0,0,0,0|2,0,0]=4 3352 B10R1.113 CN([13CH3])c1cccc(c1)I 2230a_100000221217_200025704644 [1,1,0,0,0,0|2,0,0]=4 3353 B10R1.113 CN([13CH3])c1cccc(c1)I 269982a_100000221217_200025704644 [1,1,0,0,0,0|2,0,0]=4 3354 B10R1.113 CN([13CH3])c1cccc(c1)I 34a_100000221217_200025704644 [1,1,0,0,0,0|2,0,0]=4 3355 B10R1.113 CN([13CH3])c1cccc(c1)O 2230a_100000756613_200025704644 [1,1,0,0,0,0|2,0,0]=4 3356 B10R1.113 CN([13CH3])c1cccc(c1)O 269982a_100000756613_200025704644 [1,1,0,0,0,0|2,0,0]=4 3357 B10R1.113 CN([13CH3])c1cccc(c1)O 34a_100000756613_200025704644 [1,1,0,0,0,0|2,0,0]=4 3358 B10R1.113 CS(=O)c1cccc(c1)O 271570a_203496583355_100009816267 [1,1,0,0,0,0|1,0,0]=3 3359 B10R1.113 Cc1cccc(c1)C(=O)[13CH3] 1458a_100000189346_200025704644 [1,1,0,0,0,0|0,0,0]=2 3360 B10R1.113 Cc1cccc(c1)N(C)C 2230a_100000219674_200000210301 [1,1,0,0,0,0|2,0,0]=4 3361 B10R1.113 Cc1cccc(c1)N(C)C 269982a_100000219674_200000210301 [1,1,0,0,0,0|2,0,0]=4 3362 B10R1.113 Cc1cccc(c1)N(C)C 34a_100000219674_200000210301 [1,1,0,0,0,0|2,0,0]=4 3363 B10R1.113 Cc1cccc(c1)N(C)[13CH3] 2230a_100000219674_200025704644 [1,1,0,0,0,0|2,0,0]=4 3364 B10R1.113 Cc1cccc(c1)N(C)[13CH3] 269982a_100000219674_200025704644 [1,1,0,0,0,0|2,0,0]=4 3365 B10R1.113 Cc1cccc(c1)N(C)[13CH3] 34a_100000219674_200025704644 [1,1,0,0,0,0|2,0,0]=4 3366 B10R1.113 NC(=O)c1cc(ccn1)O 271570a_203496583355_100000229564 [1,1,0,0,0,0|2,0,0]=4 3367 B10R1.113 NC(=O)c1cccc(c1)O 271570a_203496583355_100000162208 [1,1,0,0,0,0|1,0,0]=3 3368 B10R1.113 NC(=O)c1cccc(n1)O 271570a_203496583355_100011834053 [1,1,0,0,0,0|2,0,0]=4 3369 B10R1.113 NC(=O)c1ccnc(c1)O 271570a_203496583355_100000229836 [1,1,0,0,0,0|2,0,0]=4 3370 B10R1.113 NC(=O)c1cncc(c1)O 271570a_203496583355_100000162242 [1,1,0,0,0,0|2,0,0]=4 3371 B10R1.113 [13CH3]C(=O)c1cccc(c1)Br 1458a_100000210664_200025704644 [1,1,0,0,0,0|0,0,0]=2 3372 B10R1.113 [13CH3]C(=O)c1cccc(c1)Cl 1458a_100000210390_200025704644 [1,1,0,0,0,0|0,0,0]=2 3373 B10R1.113 [13CH3]C(=O)c1cccc(c1)F 1458a_100000210950_200025704644 [1,1,0,0,0,0|0,0,0]=2 3374 B10R1.113 [13CH3]C(=O)c1cccc(c1)I 1458a_100000184098_200025704644 [1,1,0,0,0,0|0,0,0]=2 3375 B10R1.113 [13CH3]C(=O)c1cccc(c1)O 1458a_100000183914_200025704644 [1,1,0,0,0,0|0,0,0]=2 3376 B10R1.14 CCC(=O)c1ccc(s1)O 271570a_203496583355_200011203577 [0,1,0,0,1,0|2,0,0]=4 3377 B10R1.14 CNC(=O)c1ccc(o1)O 271570a_203496583355_100000159859 [0,1,0,0,1,0|2,0,0]=4 3378 B10R1.14 CNC(=O)c1ccc(s1)O 271570a_203496583355_200000155069 [0,1,0,0,1,0|2,0,0]=4 3379 B10R1.14 COC(=O)c1c[nH]c(c1)O 271570a_203496583355_100009840242 [0,1,0,0,1,0|2,0,0]=4 3380 B10R1.14 COC(=O)c1cc(co1)O 271570a_203496583355_100009992624 [0,1,0,0,1,0|2,0,0]=4 3381 B10R1.14 COC(=O)c1cc(cs1)O 271570a_203496583355_100009815473 [0,1,0,0,1,0|2,0,0]=4 3382 B10R1.14 COC(=O)c1ccc([nH]1)O 271570a_203496583355_100000687774 [0,1,0,0,1,0|2,0,0]=4 3383 B10R1.14 COC(=O)c1ccc(o1)O 271570a_203496583355_100000148852 [0,1,0,0,1,0|2,0,0]=4 3384 B10R1.14 COC(=O)c1ccc(s1)O 271570a_203496583355_100000148107 [0,1,0,0,1,0|2,0,0]=4 3385 B10R1.14 COC(=O)c1csc(c1)O 271570a_203496583355_100000692058 [0,1,0,0,1,0|2,0,0]=4 3386 B10R1.31 C=C(C)c1ccc(o1)CN 271570a_100000694244_100000708654 [0,1,0,0,1,0|2,0,0]=4 3387 B10R1.31 C=C(C)c1ccc(o1)CO 271570a_100000694244_100000246276 [0,1,0,0,1,0|2,0,0]=4 3388 B10R1.31 C=C(C)c1ccc(s1)CC 271570a_100000694244_100009844052 [0,1,0,0,1,0|2,0,0]=4 3389 B10R1.31 C=C(C)c1ccc(s1)CN 271570a_100000694244_100000737305 [0,1,0,0,1,0|2,0,0]=4 3390 B10R1.31 C=C(C)c1ccc(s1)CO 271570a_100000694244_100000246291 [0,1,0,0,1,0|2,0,0]=4 3391 B10R1.31 C=C(C)c1csc(c1)CC 271570a_100000694244_100009846239 [0,1,0,0,1,0|2,0,0]=4 3392 B10R1.31 C=C(C)c1csc(c1)CO 271570a_100000694244_100000238369 [0,1,0,0,1,0|2,0,0]=4 3393 B10R1.31 C=C(C)c1csc(c1)SC 271570a_100000694244_200010256830 [0,1,0,0,1,0|2,0,0]=4 3394 B10R1.31 C=Cc1cc(cs1)C(=O)C 271570a_100011290941_200012344231 [0,1,0,0,1,0|1,0,1]=4 3395 B10R1.31 C=Cc1ccc([nH]1)C(=O)C 271570a_100011290941_200010494458 [0,1,0,0,1,0|1,0,1]=4 3396 B10R1.31 C=Cc1ccc(o1)C(=O)C 271570a_100011290941_100000229899 [0,1,0,0,1,0|1,0,1]=4 3397 B10R1.31 C=Cc1ccc(s1)C(=O)C 271570a_100011290941_100000183331 [0,1,0,0,1,0|1,0,1]=4 3398 B10R1.31 C=Cc1csc(c1)C(=O)C 271570a_100011290941_100000718618 [0,1,0,0,1,0|1,0,1]=4 3399 B10R1.31 CC(=O)c1cc(cs1)S[13CH3] 62a_100000718618_200025704644 [0,1,0,0,1,0|1,0,0]=3 3400 B10R1.31 CC(=O)c1cc(cs1)S[13CH3] 62a_200025704644_100000718618 [0,1,0,0,1,0|1,0,0]=3 3401 B10R1.31 CC(=O)c1ccc([nH]1)S[13CH3] 62a_200010494458_200025704644 [0,1,0,0,1,0|1,0,0]=3 3402 B10R1.31 CC(=O)c1ccc(o1)S[13CH3] 62a_200025704644_100000229899 [0,1,0,0,1,0|1,0,0]=3 3403 B10R1.31 CC(=O)c1ccc(s1)S[13CH3] 62a_100000183331_200025704644 [0,1,0,0,1,0|1,0,0]=3 3404 B10R1.31 CC(=O)c1ccc(s1)S[13CH3] 62a_200025704644_200000034408 [0,1,0,0,1,0|1,0,0]=3 3405 B10R1.31 CC(=O)c1cnc(s1)S[13CH3] 62a_200010173910_200025704644 [0,1,0,0,1,0|2,0,0]=4 3406 B10R1.31 CC(=O)c1cnc(s1)S[13CH3] 62a_200025704644_200010173910 [0,1,0,0,1,0|2,0,0]=4 3407 B10R1.31 CC(=O)c1csc(c1)S[13CH3] 62a_200012344231_200025704644 [0,1,0,0,1,0|1,0,0]=3 3408 B10R1.31 CC(=O)c1csc(c1)S[13CH3] 62a_200025704644_200012344231 [0,1,0,0,1,0|1,0,0]=3 3409 B10R1.31 CC(=O)c1nc(cs1)S[13CH3] 62a_100010231720_200025704644 [0,1,0,0,1,0|2,0,0]=4 3410 B10R1.31 CC(=O)c1nc(cs1)S[13CH3] 62a_200025704644_100010231720 [0,1,0,0,1,0|2,0,0]=4 3411 B10R1.31 CC(=O)c1ncc(s1)S[13CH3] 62a_100000693680_200025704644 [0,1,0,0,1,0|2,0,0]=4 3412 B10R1.31 CC(=O)c1ncc(s1)S[13CH3] 62a_200025704644_100000693680 [0,1,0,0,1,0|2,0,0]=4 3413 B10R1.31 CC(=O)n1cc(cn1)S[13CH3] 62a_100010205889_200025704644 [0,1,0,0,1,0|2,0,0]=4 3414 B10R1.31 CC(=O)n1cc(cn1)S[13CH3] 62a_200025704644_100010205889 [0,1,0,0,1,0|2,0,0]=4 3415 B10R1.31 CNc1ncc(s1)C(=O)C 27a_100102657272_200010173910 [0,1,0,0,1,0|2,0,0]=4 3416 B10R1.31 CSc1c[nH]c(c1)C(=O)N 62a_100000229580_200000210301 [0,1,0,0,1,0|2,0,0]=4 3417 B10R1.31 CSc1c[nH]c(c1)C(=O)N 62a_200000210301_100000229580 [0,1,0,0,1,0|2,0,0]=4 3418 B10R1.31 CSc1cc(cs1)C(=O)C 62a_200000210301_200012344231 [0,1,0,0,1,0|1,0,0]=3 3419 B10R1.31 CSc1cc(cs1)C(=O)C 62a_200012344231_200000210301 [0,1,0,0,1,0|1,0,0]=3 3420 B10R1.31 CSc1cc(cs1)C(=O)N 62a_100000747962_200000210301 [0,1,0,0,1,0|2,0,0]=4 3421 B10R1.31 CSc1cc(cs1)C(=O)N 62a_200000210301_100000747962 [0,1,0,0,1,0|2,0,0]=4 3422 B10R1.31 CSc1ccc([nH]1)C(=O)C 62a_200010494458_200000210301 [0,1,0,0,1,0|1,0,0]=3 3423 B10R1.31 CSc1ccc(o1)C(=O)C 62a_200000210301_100000229899 [0,1,0,0,1,0|1,0,0]=3 3424 B10R1.31 CSc1ccc(s1)C(=O)C 62a_100000183331_200000210301 [0,1,0,0,1,0|1,0,0]=3 3425 B10R1.31 CSc1ccc(s1)C(=O)C 62a_200000210301_200000034408 [0,1,0,0,1,0|1,0,0]=3 3426 B10R1.31 CSc1ccc(s1)C(=O)N 62a_100000162267_200000210301 [0,1,0,0,1,0|2,0,0]=4 3427 B10R1.31 CSc1cnc(s1)C(=O)C 62a_100000693680_200000210301 [0,1,0,0,1,0|2,0,0]=4 3428 B10R1.31 CSc1cnc(s1)C(=O)C 62a_200000210301_100000693680 [0,1,0,0,1,0|2,0,0]=4 3429 B10R1.31 CSc1cnn(c1)C(=O)C 62a_100010205889_200000210301 [0,1,0,0,1,0|2,0,0]=4 3430 B10R1.31 CSc1cnn(c1)C(=O)C 62a_200000210301_100010205889 [0,1,0,0,1,0|2,0,0]=4 3431 B10R1.31 CSc1coc(c1)C(=O)N 62a_200000210301_200009817131 [0,1,0,0,1,0|2,0,0]=4 3432 B10R1.31 CSc1coc(c1)C(=O)N 62a_200009817131_200000210301 [0,1,0,0,1,0|2,0,0]=4 3433 B10R1.31 CSc1csc(c1)C(=O)C 62a_100000718618_200000210301 [0,1,0,0,1,0|1,0,0]=3 3434 B10R1.31 CSc1csc(c1)C(=O)C 62a_200000210301_100000718618 [0,1,0,0,1,0|1,0,0]=3 3435 B10R1.31 CSc1csc(c1)C(=O)N 62a_100009812991_200000210301 [0,1,0,0,1,0|2,0,0]=4 3436 B10R1.31 CSc1csc(c1)C(=O)N 62a_200000210301_100009812991 [0,1,0,0,1,0|2,0,0]=4 3437 B10R1.31 CSc1csc(n1)C(=O)C 62a_100010231720_200000210301 [0,1,0,0,1,0|2,0,0]=4 3438 B10R1.31 CSc1csc(n1)C(=O)C 62a_200000210301_100010231720 [0,1,0,0,1,0|2,0,0]=4 3439 B10R1.31 CSc1ncc(s1)C(=O)C 62a_200000210301_200010173910 [0,1,0,0,1,0|2,0,0]=4 3440 B10R1.31 CSc1ncc(s1)C(=O)C 62a_200010173910_200000210301 [0,1,0,0,1,0|2,0,0]=4 3441 B10R1.31 [13CH3]Sc1c[nH]c(c1)C(=O)N 62a_100000229580_200025704644 [0,1,0,0,1,0|2,0,0]=4 3442 B10R1.31 [13CH3]Sc1c[nH]c(c1)C(=O)N 62a_200025704644_100000229580 [0,1,0,0,1,0|2,0,0]=4 3443 B10R1.31 [13CH3]Sc1cc(cs1)C(=O)N 62a_100000747962_200025704644 [0,1,0,0,1,0|2,0,0]=4 3444 B10R1.31 [13CH3]Sc1cc(cs1)C(=O)N 62a_200025704644_100000747962 [0,1,0,0,1,0|2,0,0]=4 3445 B10R1.31 [13CH3]Sc1ccc(s1)C(=O)N 62a_100000162267_200025704644 [0,1,0,0,1,0|2,0,0]=4 3446 B10R1.31 [13CH3]Sc1coc(c1)C(=O)N 62a_200009817131_200025704644 [0,1,0,0,1,0|2,0,0]=4 3447 B10R1.31 [13CH3]Sc1coc(c1)C(=O)N 62a_200025704644_200009817131 [0,1,0,0,1,0|2,0,0]=4 3448 B10R1.31 [13CH3]Sc1csc(c1)C(=O)N 62a_100009812991_200025704644 [0,1,0,0,1,0|2,0,0]=4 3449 B10R1.31 [13CH3]Sc1csc(c1)C(=O)N 62a_200025704644_100009812991 [0,1,0,0,1,0|2,0,0]=4 3450 B10R1.58 C=C(C)c1cc(c(s1)C)C 271570a_100000694244_100009850898 [0,1,0,0,1,0|2,0,0]=4 3451 B10R1.58 CC(=O)c1cc(c(s1)O)C 271570a_203496583355_100000729792 [0,1,0,0,1,0|1,0,0]=3 3452 B10R1.59 C=C(C)c1cc(sc1C)C 271570a_100000694244_100000688054 [0,1,0,0,1,0|2,0,0]=4 3453 B10R1.59 C=C(C)c1sc(cc1C)C 271570a_100000694244_100000689295 [0,1,0,0,1,0|2,0,0]=4 3454 B10R1.194 C=C(C)c1csc(c1C)C 271570a_100000694244_100009820295 [0,1,0,0,1,0|2,0,0]=4 3455 B10R1.194 CC(=O)c1c[nH]c(c1C)O 271570a_203496583355_200010235672 [0,1,0,0,1,0|2,0,0]=4 3456 B12R1.4 C#Cc1ccc(cc1)CC(=O)C 1458a_100000070787_100000140223 [0,1,0,0,0,1|0,0,1]=3 3457 B12R1.4 C#Cc1ccc(cc1)CC(=O)C 1458a_200009884166_200000210301 [0,1,0,0,0,1|0,0,1]=3 3458 B12R1.4 C#Cc1ccc(cc1)CC(=O)[13CH3] 1458a_200009884166_200025704644 [0,1,0,0,0,1|0,0,1]=3 3459 B12R1.4 C#Cc1ccc(cc1)NC(=O)C 11a_100011215031_100015343762 [0,1,0,0,0,1|0,0,1]=3 3460 B12R1.4 C#Cc1ccc(cc1)NC(=O)C 1626a_100011215031_100015343762 [0,1,0,0,0,1|0,0,1]=3 3461 B12R1.4 C#Cc1ccc(cc1)NC(=O)C 22a_100011215031_100000070787 [0,1,0,0,0,1|0,0,1]=3 3462 B12R1.4 C#Cc1ccc(cc1)NC(=O)C 527a_100011215031_100103153847 [0,1,0,0,0,1|0,0,1]=3 3463 B12R1.4 C=Cc1ccc(cc1)CC(=O)C 1458a_100000070787_100000034074 [0,1,0,0,0,1|0,0,1]=3 3464 B12R1.4 C=Cc1ccc(cc1)CC(=O)C 271570a_100011290941_100000691760 [0,1,0,0,0,1|0,0,1]=3 3465 B12R1.4 C=Cc1ccc(cc1)CC(=O)N 271570a_100011290941_100000162331 [0,1,0,0,0,1|1,0,1]=4 3466 B12R1.4 C=Cc1ccc(cc1)NC(=O)C 11a_100011218248_100015343762 [0,1,0,0,0,1|0,0,1]=3 3467 B12R1.4 C=Cc1ccc(cc1)NC(=O)C 1626a_100011218248_100015343762 [0,1,0,0,0,1|0,0,1]=3 3468 B12R1.4 C=Cc1ccc(cc1)NC(=O)C 22a_100011218248_100000070787 [0,1,0,0,0,1|0,0,1]=3 3469 B12R1.4 C=Cc1ccc(cc1)NC(=O)C 271570a_100011290941_100000155215 [0,1,0,0,0,1|0,0,1]=3 3470 B12R1.4 C=Cc1ccc(cc1)NC(=O)C 527a_100011218248_100103153847 [0,1,0,0,0,1|0,0,1]=3 3471 B12R1.4 C=Cc1ccc(cc1)NC(=O)N 271570a_100011290941_100000198584 [0,1,0,0,0,1|1,0,1]=4 3472 B12R1.4 C=Cc1ccc(cc1)OC(=O)C 271570a_100011290941_100000002173 [0,1,0,0,0,1|0,0,1]=3 3473 B12R1.4 C=Cc1ccc(cc1)OC(=S)C 271570a_100011290941_200009816735 [0,1,0,0,0,1|0,1,1]=4 3474 B12R1.4 C=Cc1ccc(cc1)SC(=O)C 271570a_100011290941_200009995050 [0,1,0,0,0,1|0,0,1]=3 3475 B12R1.4 C=Cc1ccc(cn1)NC(=O)C 271570a_100011290941_100011934715 [0,1,0,0,0,1|1,0,1]=4 3476 B12R1.4 C=Cc1ccc(nc1)NC(=O)C 271570a_100011290941_100000193312 [0,1,0,0,0,1|1,0,1]=4 3477 B12R1.4 CC(=Cc1ccc(cc1)C#N)C 271570a_100102525489_100000179745 [0,1,0,0,0,1|1,0,1]=4 3478 B12R1.4 CC(=Cc1ccc(cc1)C=O)C 271570a_100102525489_100000186029 [0,1,0,0,0,1|1,0,1]=4 3479 B12R1.4 CC(=Cc1ccc(cc1)CF)C 271570a_100102525489_100010268989 [0,1,0,0,0,1|1,0,0]=3 3480 B12R1.4 CC(=Cc1ccc(cc1)CN)C 271570a_100102525489_100016989417 [0,1,0,0,0,1|1,0,0]=3 3481 B12R1.4 CC(=Cc1ccc(cc1)CO)C 271570a_100102525489_100000690907 [0,1,0,0,0,1|1,0,0]=3 3482 B12R1.4 CC(=Cc1ccc(cc1)NN)C 271570a_100102525489_100016988836 [0,1,0,0,0,1|2,0,0]=4 3483 B12R1.4 CC(=Cc1ccc(cn1)CN)C 271570a_100102525489_100009817727 [0,1,0,0,0,1|2,0,0]=4 3484 B12R1.4 CC(=Cc1ccc(cn1)CO)C 271570a_100102525489_100009816760 [0,1,0,0,0,1|2,0,0]=4 3485 B12R1.4 CC(=Cc1ccc(nc1)CN)C 271570a_100102525489_100015188789 [0,1,0,0,0,1|2,0,0]=4 3486 B12R1.4 CC(=Cc1ccc(nc1)CO)C 271570a_100102525489_100000754261 [0,1,0,0,0,1|2,0,0]=4 3487 B12R1.4 CC(=O)Cc1ccc(cc1)C#N 1458a_100000070787_100000184898 [0,1,0,0,0,1|0,0,1]=3 3488 B12R1.4 CC(=O)Cc1ccc(cc1)C#N 1458a_100000748677_200000210301 [0,1,0,0,0,1|0,0,1]=3 3489 B12R1.4 CC(=O)Cc1ccc(cc1)C=O 1458a_100000070787_100000075337 [0,1,0,0,0,1|0,0,1]=3 3490 B12R1.4 CC(=O)Cc1ccc(cc1)CO 1458a_100000070787_100000067286 [0,1,0,0,0,1|0,0,0]=2 3491 B12R1.4 CC(=O)Cc1ccc(cc1)CO 1458a_100011356463_200000210301 [0,1,0,0,0,1|0,0,0]=2 3492 B12R1.4 CC(=O)Cc1ccc(cc1)O[13CH3] 34a_100011218180_200025704644 [0,1,0,0,0,1|0,0,0]=2 3493 B12R1.4 CC(=O)Cc1ccc(cc1)O[13CH3] 7a_100011218180_200025704644 [0,1,0,0,0,1|0,0,0]=2 3494 B12R1.4 CC(=O)Cc1ccc(cc1)S[13CH3] 62a_100000691760_200025704644 [0,1,0,0,0,1|0,0,0]=2 3495 B12R1.4 CC(=O)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000691760 [0,1,0,0,0,1|0,0,0]=2 3496 B12R1.4 CC(=O)Cc1ccc(cn1)C#N 1458a_100000070787_100000693164 [0,1,0,0,0,1|1,0,1]=4 3497 B12R1.4 CC(=O)Cc1ccc(nc1)C#N 1458a_100000070787_100009816919 [0,1,0,0,0,1|1,0,1]=4 3498 B12R1.4 CC(=O)Nc1ccc(cc1)C#N 11a_100000185469_100015343762 [0,1,0,0,0,1|0,0,1]=3 3499 B12R1.4 CC(=O)Nc1ccc(cc1)C#N 1626a_100000185469_100015343762 [0,1,0,0,0,1|0,0,1]=3 3500 B12R1.4 CC(=O)Nc1ccc(cc1)CO 22a_100011215238_100000070787 [0,1,0,0,0,1|0,0,0]=2 3501 B12R1.4 CC(=O)Nc1ccc(cc1)N[13CH3] 34a_100000184111_200025704644 [0,1,0,0,0,1|0,0,0]=2 3502 B12R1.4 CC(=O)Nc1ccc(cc1)O[13CH3] 34a_100000184395_200025704644 [0,1,0,0,0,1|0,0,0]=2 3503 B12R1.4 CC(=O)Nc1ccc(cc1)O[13CH3] 7a_100000184395_200025704644 [0,1,0,0,0,1|0,0,0]=2 3504 B12R1.4 CC(=O)Nc1ccc(cc1)S[13CH3] 62a_200025704644_100000155215 [0,1,0,0,0,1|0,0,0]=2 3505 B12R1.4 CC(=O)Nc1ccc(cn1)O[13CH3] 34a_200000094647_200025704644 [0,1,0,0,0,1|1,0,0]=3 3506 B12R1.4 CC(=O)Nc1ccc(cn1)O[13CH3] 7a_200000094647_200025704644 [0,1,0,0,0,1|1,0,0]=3 3507 B12R1.4 CC(=O)Nc1ccc(cn1)S[13CH3] 62a_200025704644_100000193312 [0,1,0,0,0,1|1,0,0]=3 3508 B12R1.4 CC(=O)Nc1ccc(nc1)S[13CH3] 62a_200025704644_100011934715 [0,1,0,0,0,1|1,0,0]=3 3509 B12R1.4 CC(=O)Nc1ccc(nn1)S[13CH3] 62a_200025704644_100011804224 [0,1,0,0,0,1|2,0,0]=4 3510 B12R1.4 CC(=O)Nc1cnc(nc1)S[13CH3] 62a_200025704644_200010565192 [0,1,0,0,0,1|2,0,0]=4 3511 B12R1.4 CC(=O)Nc1ncc(cn1)S[13CH3] 62a_100010141023_200025704644 [0,1,0,0,0,1|2,0,0]=4 3512 B12R1.4 CC(=O)Nc1ncc(cn1)S[13CH3] 62a_200025704644_100010141023 [0,1,0,0,0,1|2,0,0]=4 3513 B12R1.4 CC(=O)Oc1ccc(cc1)S[13CH3] 62a_200025704644_100000002173 [0,1,0,0,0,1|0,0,0]=2 3514 B12R1.4 CC(=O)Sc1ccc(cc1)S[13CH3] 62a_200009995050_200025704644 [0,1,0,0,0,1|0,0,0]=2 3515 B12R1.4 CC(=S)Oc1ccc(cc1)S[13CH3] 62a_200025704644_200009816735 [0,1,0,0,0,1|0,1,0]=3 3516 B12R1.4 CC(C)Cc1ccc(cc1)N[13CH3] 2230a_100000687309_200025704644 [0,1,0,0,0,1|1,0,1]=4 3517 B12R1.4 CC(C)Cc1ccc(cc1)N[13CH3] 34a_100000687309_200025704644 [0,1,0,0,0,1|1,0,1]=4 3518 B12R1.4 CC(C)Cc1ccc(cc1)S[13CH3] 62a_100011221366_200025704644 [0,1,0,0,0,1|1,0,1]=4 3519 B12R1.4 CC(C)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100011221366 [0,1,0,0,0,1|1,0,1]=4 3520 B12R1.4 CC(C)Nc1ccc(cc1)CO 2230a_100011215238_100000210206 [0,1,0,0,0,1|1,0,1]=4 3521 B12R1.4 CC(C)Nc1ccc(cc1)CO 34a_100011215238_100000210206 [0,1,0,0,0,1|1,0,1]=4 3522 B12R1.4 CC(C)Nc1ccc(cc1)S[13CH3] 62a_100000219625_200025704644 [0,1,0,0,0,1|1,0,1]=4 3523 B12R1.4 CC(C)Nc1ccc(cc1)S[13CH3] 62a_200025704644_100000219625 [0,1,0,0,0,1|1,0,1]=4 3524 B12R1.4 CC(C)Oc1ccc(cc1)CN 34a_100000185549_100000210206 [0,1,0,0,0,1|1,0,1]=4 3525 B12R1.4 CC(C)Oc1ccc(cc1)CO 34a_100000211755_100000210206 [0,1,0,0,0,1|1,0,1]=4 3526 B12R1.4 CC(C)Oc1ccc(cc1)N[13CH3] 2230a_100011194259_200025704644 [0,1,0,0,0,1|1,0,1]=4 3527 B12R1.4 CC(C)Oc1ccc(cc1)N[13CH3] 34a_100011194259_200025704644 [0,1,0,0,0,1|1,0,1]=4 3528 B12R1.4 CC(C)Oc1ccc(cc1)O[13CH3] 34a_100000757185_200025704644 [0,1,0,0,0,1|1,0,1]=4 3529 B12R1.4 CC(C)Oc1ccc(cc1)O[13CH3] 7a_100000757185_200025704644 [0,1,0,0,0,1|1,0,1]=4 3530 B12R1.4 CC(C)Oc1ccc(cc1)S[13CH3] 62a_100000169947_200025704644 [0,1,0,0,0,1|1,0,1]=4 3531 B12R1.4 CC(C)Oc1ccc(cc1)S[13CH3] 62a_200025704644_100000169947 [0,1,0,0,0,1|1,0,1]=4 3532 B12R1.4 CC(C)Sc1ccc(cc1)CF 62a_100000210206_100010268989 [0,1,0,0,0,1|1,0,1]=4 3533 B12R1.4 CC(C)Sc1ccc(cc1)CF 62a_100010268989_100000210206 [0,1,0,0,0,1|1,0,1]=4 3534 B12R1.4 CC(C)Sc1ccc(cc1)CN 62a_100000210206_100016989417 [0,1,0,0,0,1|1,0,1]=4 3535 B12R1.4 CC(C)Sc1ccc(cc1)CN 62a_100016989417_100000210206 [0,1,0,0,0,1|1,0,1]=4 3536 B12R1.4 CC(C)Sc1ccc(cc1)CO 62a_100000210206_100000690907 [0,1,0,0,0,1|1,0,1]=4 3537 B12R1.4 CC(C)Sc1ccc(cc1)CO 62a_100000690907_100000210206 [0,1,0,0,0,1|1,0,1]=4 3538 B12R1.4 CC(C)Sc1ccc(cc1)S[13CH3] 62a_100009811894_200025704644 [0,1,0,0,0,1|1,0,1]=4 3539 B12R1.4 CC(C)Sc1ccc(cc1)S[13CH3] 62a_200025704644_100009811894 [0,1,0,0,0,1|1,0,1]=4 3540 B12R1.4 CC(N)Cc1ccc(cc1)O[13CH3] 34a_100102634573_200025704644 [0,1,0,0,0,1|1,0,1]=4 3541 B12R1.4 CCc1ccc(cc1)C=C(C)C 271570a_100102525489_100011215824 [0,1,0,0,0,1|1,0,0]=3 3542 B12R1.4 CCc1ccc(cc1)CC(=O)C 1458a_100000070787_100000747183 [0,1,0,0,0,1|0,0,0]=2 3543 B12R1.4 CCc1ccc(cc1)CC(=O)C 1458a_200000759805_200000210301 [0,1,0,0,0,1|0,0,0]=2 3544 B12R1.4 CCc1ccc(cc1)CC(=O)[13CH3] 1458a_200000759805_200025704644 [0,1,0,0,0,1|0,0,0]=2 3545 B12R1.4 CCc1ccc(cc1)CN(C)C 2230a_100000683253_200000210301 [0,1,0,0,0,1|2,0,0]=4 3546 B12R1.4 CCc1ccc(cc1)CN(C)C 2230a_100102631434_100000747183 [0,1,0,0,0,1|2,0,0]=4 3547 B12R1.4 CCc1ccc(cc1)CN(C)C 269982a_100000683253_200000210301 [0,1,0,0,0,1|2,0,0]=4 3548 B12R1.4 CCc1ccc(cc1)CN(C)C 269982a_100102631434_100000747183 [0,1,0,0,0,1|2,0,0]=4 3549 B12R1.4 CCc1ccc(cc1)CN(C)C 270004a_100102631434_100000211036 [0,1,0,0,0,1|2,0,0]=4 3550 B12R1.4 CCc1ccc(cc1)CN(C)[13CH3] 2230a_100000683253_200025704644 [0,1,0,0,0,1|2,0,0]=4 3551 B12R1.4 CCc1ccc(cc1)CN(C)[13CH3] 269982a_100000683253_200025704644 [0,1,0,0,0,1|2,0,0]=4 3552 B12R1.4 CCc1ccc(cc1)NC(=O)C 11a_100000211069_100015343762 [0,1,0,0,0,1|0,0,0]=2 3553 B12R1.4 CCc1ccc(cc1)NC(=O)C 1626a_100000211069_100015343762 [0,1,0,0,0,1|0,0,0]=2 3554 B12R1.4 CCc1ccc(cc1)NC(=O)C 22a_100000211069_100000070787 [0,1,0,0,0,1|0,0,0]=2 3555 B12R1.4 CCc1ccc(cc1)NC(=O)C 527a_100000211069_100103153847 [0,1,0,0,0,1|0,0,0]=2 3556 B12R1.4 CCc1ccc(cc1)NC(C)C 2230a_100000211069_100000210206 [0,1,0,0,0,1|1,0,1]=4 3557 B12R1.4 CCc1ccc(cc1)NC(C)C 34a_100000211069_100000210206 [0,1,0,0,0,1|1,0,1]=4 3558 B12R1.4 CCc1ccc(cc1)OC(C)C 34a_100000211359_100000210206 [0,1,0,0,0,1|1,0,1]=4 3559 B12R1.4 CCc1ccc(cc1)OC(C)C 7a_100000211359_100000210206 [0,1,0,0,0,1|1,0,1]=4 3560 B12R1.4 CCc1ccc(cc1)SC(C)C 62a_100000210206_100011215824 [0,1,0,0,0,1|1,0,1]=4 3561 B12R1.4 CCc1ccc(cc1)SC(C)C 62a_100011215824_100000210206 [0,1,0,0,0,1|1,0,1]=4 3562 B12R1.4 CCc1ccc(cn1)C=C(C)C 271570a_100102525489_100009820025 [0,1,0,0,0,1|2,0,0]=4 3563 B12R1.4 CCc1ccc(nc1)C=C(C)C 271570a_100102525489_100009843584 [0,1,0,0,0,1|2,0,0]=4 3564 B12R1.4 CN(C)Cc1ccc(cc1)CO 2230a_100102631434_100000067286 [0,1,0,0,0,1|2,0,0]=4 3565 B12R1.4 CN(C)Cc1ccc(cc1)CO 269982a_100102631434_100000067286 [0,1,0,0,0,1|2,0,0]=4 3566 B12R1.4 CN(C)Cc1ccc(cc1)CO 270004a_100102631434_100009832023 [0,1,0,0,0,1|2,0,0]=4 3567 B12R1.4 CN(C)Cc1ccc(cc1)S[13CH3] 62a_100000174694_200025704644 [0,1,0,0,0,1|2,0,0]=4 3568 B12R1.4 CN(C)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000174694 [0,1,0,0,0,1|2,0,0]=4 3569 B12R1.4 CNc1ccc(cc1)C=C(C)C 271570a_100102525489_100000219623 [0,1,0,0,0,1|1,0,0]=3 3570 B12R1.4 CNc1ccc(cc1)CC(=O)N 2230a_100000738315_200000210301 [0,1,0,0,0,1|1,0,0]=3 3571 B12R1.4 CNc1ccc(cc1)CC(=O)N 34a_100000738315_200000210301 [0,1,0,0,0,1|1,0,0]=3 3572 B12R1.4 CNc1ccc(cc1)CC(C)C 2230a_100000687309_200000210301 [0,1,0,0,0,1|1,0,1]=4 3573 B12R1.4 CNc1ccc(cc1)CC(C)C 34a_100000687309_200000210301 [0,1,0,0,0,1|1,0,1]=4 3574 B12R1.4 CNc1ccc(cc1)NC(=O)C 34a_100000184111_200000210301 [0,1,0,0,0,1|0,0,0]=2 3575 B12R1.4 CNc1ccc(cc1)OC(C)C 2230a_100011194259_200000210301 [0,1,0,0,0,1|1,0,1]=4 3576 B12R1.4 CNc1ccc(cc1)OC(C)C 34a_100000182112_100000210206 [0,1,0,0,0,1|1,0,1]=4 3577 B12R1.4 CNc1ccc(cc1)OC(C)C 34a_100011194259_200000210301 [0,1,0,0,0,1|1,0,1]=4 3578 B12R1.4 CNc1ccc(cc1)SC(C)C 62a_100000210206_100000743151 [0,1,0,0,0,1|1,0,1]=4 3579 B12R1.4 CNc1ccc(cc1)SC(C)C 62a_100000743151_100000210206 [0,1,0,0,0,1|1,0,1]=4 3580 B12R1.4 CNc1ccc(cn1)C=C(C)C 271570a_100102525489_100000741341 [0,1,0,0,0,1|2,0,0]=4 3581 B12R1.4 CNc1ccc(nc1)C=C(C)C 271570a_100102525489_100000764248 [0,1,0,0,0,1|2,0,0]=4 3582 B12R1.4 COc1ccc(cc1)C=C(C)C 271570a_100102525489_100000171711 [0,1,0,0,0,1|1,0,0]=3 3583 B12R1.4 COc1ccc(cc1)CC(=O)C 1458a_100000210706_200000210301 [0,1,0,0,0,1|0,0,0]=2 3584 B12R1.4 COc1ccc(cc1)CC(=O)C 34a_100011218180_200000210301 [0,1,0,0,0,1|0,0,0]=2 3585 B12R1.4 COc1ccc(cc1)CC(=O)C 7a_100011218180_200000210301 [0,1,0,0,0,1|0,0,0]=2 3586 B12R1.4 COc1ccc(cc1)CC(=O)N 34a_100000020825_200000210301 [0,1,0,0,0,1|1,0,0]=3 3587 B12R1.4 COc1ccc(cc1)CC(=O)[13CH3] 1458a_100000210706_200025704644 [0,1,0,0,0,1|0,0,0]=2 3588 B12R1.4 COc1ccc(cc1)CC(C)N 34a_100102634573_200000210301 [0,1,0,0,0,1|1,0,1]=4 3589 B12R1.4 COc1ccc(cc1)CN(C)C 2230a_100000184145_200000210301 [0,1,0,0,0,1|2,0,0]=4 3590 B12R1.4 COc1ccc(cc1)CN(C)C 2230a_100102631434_100000742318 [0,1,0,0,0,1|2,0,0]=4 3591 B12R1.4 COc1ccc(cc1)CN(C)C 269982a_100000184145_200000210301 [0,1,0,0,0,1|2,0,0]=4 3592 B12R1.4 COc1ccc(cc1)CN(C)C 269982a_100102631434_100000742318 [0,1,0,0,0,1|2,0,0]=4 3593 B12R1.4 COc1ccc(cc1)CN(C)C 270004a_100102631434_100000169835 [0,1,0,0,0,1|2,0,0]=4 3594 B12R1.4 COc1ccc(cc1)CN(C)[13CH3] 2230a_100000184145_200025704644 [0,1,0,0,0,1|2,0,0]=4 3595 B12R1.4 COc1ccc(cc1)CN(C)[13CH3] 269982a_100000184145_200025704644 [0,1,0,0,0,1|2,0,0]=4 3596 B12R1.4 COc1ccc(cc1)NC(=O)C 11a_100000184247_100015343762 [0,1,0,0,0,1|0,0,0]=2 3597 B12R1.4 COc1ccc(cc1)NC(=O)C 1626a_100000184247_100015343762 [0,1,0,0,0,1|0,0,0]=2 3598 B12R1.4 COc1ccc(cc1)NC(=O)C 22a_100000184247_100000070787 [0,1,0,0,0,1|0,0,0]=2 3599 B12R1.4 COc1ccc(cc1)NC(=O)C 34a_100000184395_200000210301 [0,1,0,0,0,1|0,0,0]=2 3600 B12R1.4 COc1ccc(cc1)NC(=O)C 527a_100000184247_100103153847 [0,1,0,0,0,1|0,0,0]=2 3601 B12R1.4 COc1ccc(cc1)NC(=O)C 7a_100000184395_200000210301 [0,1,0,0,0,1|0,0,0]=2 3602 B12R1.4 COc1ccc(cc1)NC(C)C 34a_100000184247_100000210206 [0,1,0,0,0,1|1,0,1]=4 3603 B12R1.4 COc1ccc(cc1)OC(C)C 34a_100000210503_100000210206 [0,1,0,0,0,1|1,0,1]=4 3604 B12R1.4 COc1ccc(cc1)OC(C)C 34a_100000757185_200000210301 [0,1,0,0,0,1|1,0,1]=4 3605 B12R1.4 COc1ccc(cc1)OC(C)C 7a_100000757185_200000210301 [0,1,0,0,0,1|1,0,1]=4 3606 B12R1.4 COc1ccc(cc1)SC(C)C 62a_100000210206_100000171711 [0,1,0,0,0,1|1,0,1]=4 3607 B12R1.4 COc1ccc(cn1)C=C(C)C 271570a_100102525489_100000047065 [0,1,0,0,0,1|2,0,0]=4 3608 B12R1.4 COc1ccc(cn1)CC(=O)C 1458a_100000070787_100020631284 [0,1,0,0,0,1|1,0,0]=3 3609 B12R1.4 COc1ccc(cn1)CC(=O)C 1458a_100012001117_200000210301 [0,1,0,0,0,1|1,0,0]=3 3610 B12R1.4 COc1ccc(cn1)CC(=O)[13CH3] 1458a_100012001117_200025704644 [0,1,0,0,0,1|1,0,0]=3 3611 B12R1.4 COc1ccc(nc1)C=C(C)C 271570a_100102525489_100000755202 [0,1,0,0,0,1|2,0,0]=4 3612 B12R1.4 COc1ccc(nc1)CC(=O)C 1458a_100000070787_200000757186 [0,1,0,0,0,1|1,0,0]=3 3613 B12R1.4 COc1ccc(nc1)CC(=O)C 1458a_100000722272_200000210301 [0,1,0,0,0,1|1,0,0]=3 3614 B12R1.4 COc1ccc(nc1)CC(=O)[13CH3] 1458a_100000722272_200025704644 [0,1,0,0,0,1|1,0,0]=3 3615 B12R1.4 COc1ccc(nc1)NC(=O)C 34a_200000094647_200000210301 [0,1,0,0,0,1|1,0,0]=3 3616 B12R1.4 COc1ccc(nc1)NC(=O)C 7a_200000094647_200000210301 [0,1,0,0,0,1|1,0,0]=3 3617 B12R1.4 CSc1ccc(cc1)C=C(Br)Br 62a_200000210301_200013992848 [0,1,0,0,0,1|2,0,0]=4 3618 B12R1.4 CSc1ccc(cc1)C=C(Br)Br 62a_200013992848_200000210301 [0,1,0,0,0,1|2,0,0]=4 3619 B12R1.4 CSc1ccc(cc1)C=C(C)C 271570a_100102525489_100011263217 [0,1,0,0,0,1|1,0,0]=3 3620 B12R1.4 CSc1ccc(cc1)C=C(F)F 62a_200000210301_200009816947 [0,1,0,0,0,1|2,0,0]=4 3621 B12R1.4 CSc1ccc(cc1)C=C(F)F 62a_200009816947_200000210301 [0,1,0,0,0,1|2,0,0]=4 3622 B12R1.4 CSc1ccc(cc1)CC(=O)C 1458a_100000070787_100000181263 [0,1,0,0,0,1|0,0,0]=2 3623 B12R1.4 CSc1ccc(cc1)CC(=O)C 1458a_100000756958_200000210301 [0,1,0,0,0,1|0,0,0]=2 3624 B12R1.4 CSc1ccc(cc1)CC(=O)C 62a_100000691760_200000210301 [0,1,0,0,0,1|0,0,0]=2 3625 B12R1.4 CSc1ccc(cc1)CC(=O)C 62a_200000210301_100000691760 [0,1,0,0,0,1|0,0,0]=2 3626 B12R1.4 CSc1ccc(cc1)CC(=O)N 62a_100000162331_200000210301 [0,1,0,0,0,1|1,0,0]=3 3627 B12R1.4 CSc1ccc(cc1)CC(=O)N 62a_200000210301_100000162331 [0,1,0,0,0,1|1,0,0]=3 3628 B12R1.4 CSc1ccc(cc1)CC(=O)[13CH3] 1458a_100000756958_200025704644 [0,1,0,0,0,1|0,0,0]=2 3629 B12R1.4 CSc1ccc(cc1)CC(C)C 62a_100011221366_200000210301 [0,1,0,0,0,1|1,0,1]=4 3630 B12R1.4 CSc1ccc(cc1)CC(C)C 62a_200000210301_100011221366 [0,1,0,0,0,1|1,0,1]=4 3631 B12R1.4 CSc1ccc(cc1)CN(C)C 2230a_100102631434_100000181263 [0,1,0,0,0,1|2,0,0]=4 3632 B12R1.4 CSc1ccc(cc1)CN(C)C 2230a_102495365258_200000210301 [0,1,0,0,0,1|2,0,0]=4 3633 B12R1.4 CSc1ccc(cc1)CN(C)C 269982a_100102631434_100011934452 [0,1,0,0,0,1|2,0,0]=4 3634 B12R1.4 CSc1ccc(cc1)CN(C)C 269982a_102495365258_200000210301 [0,1,0,0,0,1|2,0,0]=4 3635 B12R1.4 CSc1ccc(cc1)CN(C)C 270004a_100102631434_100000211154 [0,1,0,0,0,1|2,0,0]=4 3636 B12R1.4 CSc1ccc(cc1)CN(C)C 62a_100000174694_200000210301 [0,1,0,0,0,1|2,0,0]=4 3637 B12R1.4 CSc1ccc(cc1)CN(C)C 62a_200000210301_100000174694 [0,1,0,0,0,1|2,0,0]=4 3638 B12R1.4 CSc1ccc(cc1)CN(C)[13CH3] 2230a_102495365258_200025704644 [0,1,0,0,0,1|2,0,0]=4 3639 B12R1.4 CSc1ccc(cc1)CN(C)[13CH3] 269982a_102495365258_200025704644 [0,1,0,0,0,1|2,0,0]=4 3640 B12R1.4 CSc1ccc(cc1)NC(=O)C 11a_100000212337_100015343762 [0,1,0,0,0,1|0,0,0]=2 3641 B12R1.4 CSc1ccc(cc1)NC(=O)C 22a_100000212337_100000070787 [0,1,0,0,0,1|0,0,0]=2 3642 B12R1.4 CSc1ccc(cc1)NC(=O)C 527a_100000212337_100103153847 [0,1,0,0,0,1|0,0,0]=2 3643 B12R1.4 CSc1ccc(cc1)NC(=O)C 62a_200000210301_100000155215 [0,1,0,0,0,1|0,0,0]=2 3644 B12R1.4 CSc1ccc(cc1)NC(=O)N 62a_200000210301_100000198584 [0,1,0,0,0,1|1,0,0]=3 3645 B12R1.4 CSc1ccc(cc1)NC(C)C 34a_100000212337_100000210206 [0,1,0,0,0,1|1,0,1]=4 3646 B12R1.4 CSc1ccc(cc1)NC(C)C 62a_100000219625_200000210301 [0,1,0,0,0,1|1,0,1]=4 3647 B12R1.4 CSc1ccc(cc1)NC(C)C 62a_200000210301_100000219625 [0,1,0,0,0,1|1,0,1]=4 3648 B12R1.4 CSc1ccc(cc1)OC(=O)C 62a_200000210301_100000002173 [0,1,0,0,0,1|0,0,0]=2 3649 B12R1.4 CSc1ccc(cc1)OC(=S)C 62a_200000210301_200009816735 [0,1,0,0,0,1|0,1,0]=3 3650 B12R1.4 CSc1ccc(cc1)OC(C)C 34a_100000211864_100000210206 [0,1,0,0,0,1|1,0,1]=4 3651 B12R1.4 CSc1ccc(cc1)OC(C)C 62a_100000169947_200000210301 [0,1,0,0,0,1|1,0,1]=4 3652 B12R1.4 CSc1ccc(cc1)OC(C)C 62a_200000210301_100000169947 [0,1,0,0,0,1|1,0,1]=4 3653 B12R1.4 CSc1ccc(cc1)SC(=O)C 62a_200009995050_200000210301 [0,1,0,0,0,1|0,0,0]=2 3654 B12R1.4 CSc1ccc(cc1)SC(C)C 62a_100000210206_100011263217 [0,1,0,0,0,1|1,0,1]=4 3655 B12R1.4 CSc1ccc(cc1)SC(C)C 62a_100009811894_200000210301 [0,1,0,0,0,1|1,0,1]=4 3656 B12R1.4 CSc1ccc(cc1)SC(C)C 62a_100011263217_100000210206 [0,1,0,0,0,1|1,0,1]=4 3657 B12R1.4 CSc1ccc(cc1)SC(C)C 62a_200000210301_100009811894 [0,1,0,0,0,1|1,0,1]=4 3658 B12R1.4 CSc1ccc(cn1)C=C(C)C 271570a_100102525489_100011408404 [0,1,0,0,0,1|2,0,0]=4 3659 B12R1.4 CSc1ccc(cn1)CC(=O)N 62a_200000071513_200000210301 [0,1,0,0,0,1|2,0,0]=4 3660 B12R1.4 CSc1ccc(cn1)CC(=O)N 62a_200000210301_200000071513 [0,1,0,0,0,1|2,0,0]=4 3661 B12R1.4 CSc1ccc(cn1)NC(=O)C 62a_200000210301_100011934715 [0,1,0,0,0,1|1,0,0]=3 3662 B12R1.4 CSc1ccc(nc1)C=C(C)C 271570a_100102525489_100009820866 [0,1,0,0,0,1|2,0,0]=4 3663 B12R1.4 CSc1ccc(nc1)CC(=O)N 62a_200000210301_200010888337 [0,1,0,0,0,1|2,0,0]=4 3664 B12R1.4 CSc1ccc(nc1)CC(=O)N 62a_200010888337_200000210301 [0,1,0,0,0,1|2,0,0]=4 3665 B12R1.4 CSc1ccc(nc1)NC(=O)C 62a_200000210301_100000193312 [0,1,0,0,0,1|1,0,0]=3 3666 B12R1.4 CSc1ccc(nn1)NC(=O)C 62a_200000210301_100011804224 [0,1,0,0,0,1|2,0,0]=4 3667 B12R1.4 CSc1cnc(nc1)NC(=O)C 62a_100010141023_200000210301 [0,1,0,0,0,1|2,0,0]=4 3668 B12R1.4 CSc1cnc(nc1)NC(=O)C 62a_200000210301_100010141023 [0,1,0,0,0,1|2,0,0]=4 3669 B12R1.4 CSc1ncc(cn1)NC(=O)C 62a_200000210301_200010565192 [0,1,0,0,0,1|2,0,0]=4 3670 B12R1.4 [13CH3]C(=O)Cc1ccc(cc1)C#N 1458a_100000748677_200025704644 [0,1,0,0,0,1|0,0,1]=3 3671 B12R1.4 [13CH3]C(=O)Cc1ccc(cc1)CO 1458a_100011356463_200025704644 [0,1,0,0,0,1|0,0,0]=2 3672 B12R1.4 [13CH3]Nc1ccc(cc1)CC(=O)N 2230a_100000738315_200025704644 [0,1,0,0,0,1|1,0,0]=3 3673 B12R1.4 [13CH3]Nc1ccc(cc1)CC(=O)N 34a_100000738315_200025704644 [0,1,0,0,0,1|1,0,0]=3 3674 B12R1.4 [13CH3]Oc1ccc(cc1)CC(=O)N 34a_100000020825_200025704644 [0,1,0,0,0,1|1,0,0]=3 3675 B12R1.4 [13CH3]Sc1ccc(cc1)C=C(Br)Br 62a_200013992848_200025704644 [0,1,0,0,0,1|2,0,0]=4 3676 B12R1.4 [13CH3]Sc1ccc(cc1)C=C(Br)Br 62a_200025704644_200013992848 [0,1,0,0,0,1|2,0,0]=4 3677 B12R1.4 [13CH3]Sc1ccc(cc1)C=C(F)F 62a_200009816947_200025704644 [0,1,0,0,0,1|2,0,0]=4 3678 B12R1.4 [13CH3]Sc1ccc(cc1)C=C(F)F 62a_200025704644_200009816947 [0,1,0,0,0,1|2,0,0]=4 3679 B12R1.4 [13CH3]Sc1ccc(cc1)CC(=O)N 62a_100000162331_200025704644 [0,1,0,0,0,1|1,0,0]=3 3680 B12R1.4 [13CH3]Sc1ccc(cc1)CC(=O)N 62a_200025704644_100000162331 [0,1,0,0,0,1|1,0,0]=3 3681 B12R1.4 [13CH3]Sc1ccc(cc1)NC(=O)N 62a_200025704644_100000198584 [0,1,0,0,0,1|1,0,0]=3 3682 B12R1.4 [13CH3]Sc1ccc(cn1)CC(=O)N 62a_200000071513_200025704644 [0,1,0,0,0,1|2,0,0]=4 3683 B12R1.4 [13CH3]Sc1ccc(cn1)CC(=O)N 62a_200025704644_200000071513 [0,1,0,0,0,1|2,0,0]=4 3684 B12R1.4 [13CH3]Sc1ccc(nc1)CC(=O)N 62a_200010888337_200025704644 [0,1,0,0,0,1|2,0,0]=4 3685 B12R1.4 [13CH3]Sc1ccc(nc1)CC(=O)N 62a_200025704644_200010888337 [0,1,0,0,0,1|2,0,0]=4 3686 B12R1.19 CC(=Cc1cc(c(cn1)C)C)C 271570a_100102525489_100009850809 [0,1,0,0,0,1|2,0,0]=4 3687 B12R1.19 CC(=Cc1cc(c(cn1)C)F)C 271570a_100102525489_100009841206 [0,1,0,0,0,1|2,0,0]=4 3688 B12R1.19 CC(=Cc1cc(c(cn1)C)N)C 271570a_100102525489_100000690170 [0,1,0,0,0,1|2,0,0]=4 3689 B12R1.19 CC(=Cc1cc(c(cn1)C)O)C 271570a_100102525489_100000704368 [0,1,0,0,0,1|2,0,0]=4 3690 B12R1.19 CC(=Cc1ccc([n+](c1)[O-])C)C 271570a_100102525489_100000703231 [0,1,0,0,0,1|2,0,0]=4 3691 B12R1.19 CC(=Cc1ccc(c(c1)Br)Br)C 271570a_100102525489_100012356285 [0,1,0,0,0,1|2,0,0]=4 3692 B12R1.19 CC(=Cc1ccc(c(c1)Br)C)C 271570a_100102525489_100011847877 [0,1,0,0,0,1|1,0,0]=3 3693 B12R1.19 CC(=Cc1ccc(c(c1)Br)Cl)C 271570a_100102525489_100012353702 [0,1,0,0,0,1|2,0,0]=4 3694 B12R1.19 CC(=Cc1ccc(c(c1)Br)F)C 271570a_100102525489_100012047266 [0,1,0,0,0,1|2,0,0]=4 3695 B12R1.19 CC(=Cc1ccc(c(c1)Br)N)C 271570a_100102525489_100000750455 [0,1,0,0,0,1|2,0,0]=4 3696 B12R1.19 CC(=Cc1ccc(c(c1)Br)O)C 271570a_100102525489_100012361655 [0,1,0,0,0,1|2,0,0]=4 3697 B12R1.19 CC(=Cc1ccc(c(c1)C)Br)C 271570a_100102525489_100009813585 [0,1,0,0,0,1|2,0,0]=4 3698 B12R1.19 CC(=Cc1ccc(c(c1)C)C)C 271570a_100102525489_100011215607 [0,1,0,0,0,1|1,0,0]=3 3699 B12R1.19 CC(=Cc1ccc(c(c1)C)Cl)C 271570a_100102525489_100000049509 [0,1,0,0,0,1|2,0,0]=4 3700 B12R1.19 CC(=Cc1ccc(c(c1)C)F)C 271570a_100102525489_100011218330 [0,1,0,0,0,1|2,0,0]=4 3701 B12R1.19 CC(=Cc1ccc(c(c1)C)N)C 271570a_100102525489_100000211769 [0,1,0,0,0,1|2,0,0]=4 3702 B12R1.19 CC(=Cc1ccc(c(c1)C)O)C 271570a_100102525489_100000186361 [0,1,0,0,0,1|2,0,0]=4 3703 B12R1.19 CC(=Cc1ccc(c(c1)Cl)Br)C 271570a_100102525489_100012047281 [0,1,0,0,0,1|2,0,0]=4 3704 B12R1.19 CC(=Cc1ccc(c(c1)Cl)C)C 271570a_100102525489_100011216363 [0,1,0,0,0,1|1,0,0]=3 3705 B12R1.19 CC(=Cc1ccc(c(c1)Cl)Cl)C 271570a_100102525489_100011214914 [0,1,0,0,0,1|2,0,0]=4 3706 B12R1.19 CC(=Cc1ccc(c(c1)Cl)F)C 271570a_100102525489_100011215976 [0,1,0,0,0,1|2,0,0]=4 3707 B12R1.19 CC(=Cc1ccc(c(c1)Cl)N)C 271570a_100102525489_100011218065 [0,1,0,0,0,1|2,0,0]=4 3708 B12R1.19 CC(=Cc1ccc(c(c1)Cl)O)C 271570a_100102525489_100012360047 [0,1,0,0,0,1|2,0,0]=4 3709 B12R1.19 CC(=Cc1ccc(c(c1)F)Br)C 271570a_100102525489_100000685389 [0,1,0,0,0,1|2,0,0]=4 3710 B12R1.19 CC(=Cc1ccc(c(c1)F)C)C 271570a_100102525489_100000720648 [0,1,0,0,0,1|1,0,0]=3 3711 B12R1.19 CC(=Cc1ccc(c(c1)F)Cl)C 271570a_100102525489_100011216805 [0,1,0,0,0,1|2,0,0]=4 3712 B12R1.19 CC(=Cc1ccc(c(c1)F)F)C 271570a_100102525489_100000750028 [0,1,0,0,0,1|2,0,0]=4 3713 B12R1.19 CC(=Cc1ccc(c(c1)F)N)C 271570a_100102525489_100011215594 [0,1,0,0,0,1|2,0,0]=4 3714 B12R1.19 CC(=Cc1ccc(c(c1)F)O)C 271570a_100102525489_100000185481 [0,1,0,0,0,1|2,0,0]=4 3715 B12R1.19 CC(=Cc1ccc(c(c1)N)Br)C 271570a_100102525489_100000750456 [0,1,0,0,0,1|2,0,0]=4 3716 B12R1.19 CC(=Cc1ccc(c(c1)N)C)C 271570a_100102525489_100000761890 [0,1,0,0,0,1|1,0,0]=3 3717 B12R1.19 CC(=Cc1ccc(c(c1)N)Cl)C 271570a_100102525489_200000761891 [0,1,0,0,0,1|2,0,0]=4 3718 B12R1.19 CC(=Cc1ccc(c(c1)N)F)C 271570a_100102525489_100000740924 [0,1,0,0,0,1|2,0,0]=4 3719 B12R1.19 CC(=Cc1ccc(c(c1)N)N)C 271570a_100102525489_100000741789 [0,1,0,0,0,1|2,0,0]=4 3720 B12R1.19 CC(=Cc1ccc(c(c1)N)O)C 271570a_100102525489_100000752626 [0,1,0,0,0,1|2,0,0]=4 3721 B12R1.19 CC(=Cc1ccc(c(c1)O)Br)C 271570a_100102525489_100012356990 [0,1,0,0,0,1|2,0,0]=4 3722 B12R1.19 CC(=Cc1ccc(c(c1)O)C)C 271570a_100102525489_100000766334 [0,1,0,0,0,1|1,0,0]=3 3723 B12R1.19 CC(=Cc1ccc(c(c1)O)Cl)C 271570a_100102525489_100011356854 [0,1,0,0,0,1|2,0,0]=4 3724 B12R1.19 CC(=Cc1ccc(c(c1)O)F)C 271570a_100102525489_100000686035 [0,1,0,0,0,1|2,0,0]=4 3725 B12R1.19 CC(=Cc1ccc(c(c1)O)N)C 271570a_100102525489_100000739049 [0,1,0,0,0,1|2,0,0]=4 3726 B12R1.19 CC(=Cc1ccc(c(c1)O)O)C 271570a_100102525489_100009813601 [0,1,0,0,0,1|2,0,0]=4 3727 B12R1.19 CC(=Cc1ccc(c(n1)C)C)C 271570a_100102525489_100000103781 [0,1,0,0,0,1|2,0,0]=4 3728 B12R1.19 CC(=Cc1ccc(c(n1)N)C)C 271570a_100102525489_100009857032 [0,1,0,0,0,1|2,0,0]=4 3729 B12R1.19 CC(=Cc1ccn(c(=O)c1)C)C 271570a_100102525489_100009820031 [0,1,0,0,0,1|2,0,0]=4 3730 B12R1.19 CC(=Cc1cnc(c(c1)C)C)C 271570a_100102525489_100000697892 [0,1,0,0,0,1|2,0,0]=4 3731 B12R1.19 CC(=Cc1cnc(c(c1)F)C)C 271570a_100102525489_100009845756 [0,1,0,0,0,1|2,0,0]=4 3732 B12R1.19 CC(=Cc1cnc(c(c1)N)C)C 271570a_100102525489_100011999542 [0,1,0,0,0,1|2,0,0]=4 3733 B12R1.19 CC(=Cc1cnc(c(c1)O)C)C 271570a_100102525489_100009864810 [0,1,0,0,0,1|2,0,0]=4 3734 B12R1.19 CC(=O)Cc1cc(=O)c(co1)O 1458a_100000070787_100000010605 [0,1,0,0,0,1|2,0,0]=4 3735 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)Br 1458a_100000070787_100012353900 [0,1,0,0,0,1|1,0,0]=3 3736 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)C 1458a_100000070787_100012232412 [0,1,0,0,0,1|0,0,0]=2 3737 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)C 1458a_100000709925_200000210301 [0,1,0,0,0,1|0,0,0]=2 3738 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100000070787_100012353894 [0,1,0,0,0,1|1,0,0]=3 3739 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100012349508_200000210301 [0,1,0,0,0,1|1,0,0]=3 3740 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)F 1458a_100000070787_100011206884 [0,1,0,0,0,1|1,0,0]=3 3741 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)F 1458a_100000742997_200000210301 [0,1,0,0,0,1|1,0,0]=3 3742 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_200000210301 [0,1,0,0,0,1|1,0,0]=3 3743 B12R1.19 CC(=O)Cc1ccc(c(c1)C)Br 1458a_100000070787_100000727479 [0,1,0,0,0,1|1,0,0]=3 3744 B12R1.19 CC(=O)Cc1ccc(c(c1)C)Br 1458a_100012340274_200000210301 [0,1,0,0,0,1|1,0,0]=3 3745 B12R1.19 CC(=O)Cc1ccc(c(c1)C)C 1458a_100000070787_100000742320 [0,1,0,0,0,1|0,0,0]=2 3746 B12R1.19 CC(=O)Cc1ccc(c(c1)C)C 1458a_100000184070_200000210301 [0,1,0,0,0,1|0,0,0]=2 3747 B12R1.19 CC(=O)Cc1ccc(c(c1)C)Cl 1458a_100000070787_100012184735 [0,1,0,0,0,1|1,0,0]=3 3748 B12R1.19 CC(=O)Cc1ccc(c(c1)C)F 1458a_100000070787_100011216667 [0,1,0,0,0,1|1,0,0]=3 3749 B12R1.19 CC(=O)Cc1ccc(c(c1)C)F 1458a_100011667458_200000210301 [0,1,0,0,0,1|1,0,0]=3 3750 B12R1.19 CC(=O)Cc1ccc(c(c1)C)O 1458a_100000083968_200000210301 [0,1,0,0,0,1|1,0,0]=3 3751 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000070787_100012353895 [0,1,0,0,0,1|1,0,0]=3 3752 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000766880_200000210301 [0,1,0,0,0,1|1,0,0]=3 3753 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)C 1458a_100000070787_100011823929 [0,1,0,0,0,1|0,0,0]=2 3754 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000070787_100000184707 [0,1,0,0,0,1|1,0,0]=3 3755 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000210702_200000210301 [0,1,0,0,0,1|1,0,0]=3 3756 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)F 1458a_100000070787_100000717365 [0,1,0,0,0,1|1,0,0]=3 3757 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)F 1458a_100011217296_200000210301 [0,1,0,0,0,1|1,0,0]=3 3758 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)I 1458a_100000070787_100012349665 [0,1,0,0,0,1|1,0,0]=3 3759 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_200000210301 [0,1,0,0,0,1|1,0,0]=3 3760 B12R1.19 CC(=O)Cc1ccc(c(c1)F)Br 1458a_100000070787_100000767054 [0,1,0,0,0,1|1,0,0]=3 3761 B12R1.19 CC(=O)Cc1ccc(c(c1)F)Br 1458a_100000691132_200000210301 [0,1,0,0,0,1|1,0,0]=3 3762 B12R1.19 CC(=O)Cc1ccc(c(c1)F)C 1458a_100000070787_100011217369 [0,1,0,0,0,1|0,0,0]=2 3763 B12R1.19 CC(=O)Cc1ccc(c(c1)F)C 1458a_100011217375_200000210301 [0,1,0,0,0,1|0,0,0]=2 3764 B12R1.19 CC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000070787_100000716492 [0,1,0,0,0,1|1,0,0]=3 3765 B12R1.19 CC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000722404_200000210301 [0,1,0,0,0,1|1,0,0]=3 3766 B12R1.19 CC(=O)Cc1ccc(c(c1)F)F 1458a_100000070787_100000757363 [0,1,0,0,0,1|1,0,0]=3 3767 B12R1.19 CC(=O)Cc1ccc(c(c1)F)F 1458a_100000684721_200000210301 [0,1,0,0,0,1|1,0,0]=3 3768 B12R1.19 CC(=O)Cc1ccc(c(c1)F)I 1458a_100000070787_100010149604 [0,1,0,0,0,1|1,0,0]=3 3769 B12R1.19 CC(=O)Cc1ccc(c(c1)F)I 1458a_100010149632_200000210301 [0,1,0,0,0,1|1,0,0]=3 3770 B12R1.19 CC(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_200000210301 [0,1,0,0,0,1|1,0,0]=3 3771 B12R1.19 CC(=O)Cc1ccc(c(c1)I)Br 1458a_100000070787_100010146616 [0,1,0,0,0,1|1,0,0]=3 3772 B12R1.19 CC(=O)Cc1ccc(c(c1)I)C 1458a_100000070787_100010206137 [0,1,0,0,0,1|0,0,0]=2 3773 B12R1.19 CC(=O)Cc1ccc(c(c1)I)F 1458a_100000070787_100010188208 [0,1,0,0,0,1|1,0,0]=3 3774 B12R1.19 CC(=O)Cc1ccc(c(c1)O)C 1458a_100000082272_200000210301 [0,1,0,0,0,1|0,0,0]=2 3775 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200000210301 [0,1,0,0,0,1|1,0,0]=3 3776 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 271570a_203496583355_100010141077 [0,1,0,0,0,1|1,0,0]=3 3777 B12R1.19 CC(=O)Cc1cnc(c(c1)Br)F 1458a_100000070787_200010066439 [0,1,0,0,0,1|2,0,0]=4 3778 B12R1.19 CC(=O)Cc1cnc(c(c1)Cl)Cl 1458a_100000070787_100009843750 [0,1,0,0,0,1|2,0,0]=4 3779 B12R1.19 CC(=O)Cc1cnc(c(c1)I)Cl 1458a_100000070787_100011072623 [0,1,0,0,0,1|2,0,0]=4 3780 B12R1.19 CC(=O)Nc1cc(c(cn1)O)C 271570a_203496583355_100011934553 [0,1,0,0,0,1|2,0,0]=4 3781 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Br 11a_100011306057_100015343762 [0,1,0,0,0,1|1,0,0]=3 3782 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Br 1626a_100011306057_100015343762 [0,1,0,0,0,1|1,0,0]=3 3783 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Br 22a_100011306057_100000070787 [0,1,0,0,0,1|1,0,0]=3 3784 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Br 527a_100011306057_100103153847 [0,1,0,0,0,1|1,0,0]=3 3785 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)C 11a_100000736455_100015343762 [0,1,0,0,0,1|0,0,0]=2 3786 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)C 1626a_100000736455_100015343762 [0,1,0,0,0,1|0,0,0]=2 3787 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)C 22a_100000736455_100000070787 [0,1,0,0,0,1|0,0,0]=2 3788 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)C 527a_100000736455_100103153847 [0,1,0,0,0,1|0,0,0]=2 3789 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Cl 11a_100000686031_100015343762 [0,1,0,0,0,1|1,0,0]=3 3790 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Cl 1626a_100000686031_100015343762 [0,1,0,0,0,1|1,0,0]=3 3791 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Cl 22a_100000686031_100000070787 [0,1,0,0,0,1|1,0,0]=3 3792 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Cl 527a_100000686031_100103153847 [0,1,0,0,0,1|1,0,0]=3 3793 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)F 11a_100000760356_100015343762 [0,1,0,0,0,1|1,0,0]=3 3794 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)F 1626a_100000760356_100015343762 [0,1,0,0,0,1|1,0,0]=3 3795 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)F 22a_100000760356_100000070787 [0,1,0,0,0,1|1,0,0]=3 3796 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)F 527a_100000760356_100103153847 [0,1,0,0,0,1|1,0,0]=3 3797 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)I 11a_100000750458_100015343762 [0,1,0,0,0,1|1,0,0]=3 3798 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)I 1626a_100000750458_100015343762 [0,1,0,0,0,1|1,0,0]=3 3799 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)I 22a_100000750458_100000070787 [0,1,0,0,0,1|1,0,0]=3 3800 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)I 527a_100000750458_100103153847 [0,1,0,0,0,1|1,0,0]=3 3801 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)O 22a_100011534360_100000070787 [0,1,0,0,0,1|1,0,0]=3 3802 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)O 527a_100011534360_100103153847 [0,1,0,0,0,1|1,0,0]=3 3803 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Br 11a_100000210723_100015343762 [0,1,0,0,0,1|1,0,0]=3 3804 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Br 1626a_100000210723_100015343762 [0,1,0,0,0,1|1,0,0]=3 3805 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Br 22a_100000210723_100000070787 [0,1,0,0,0,1|1,0,0]=3 3806 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Br 527a_100000210723_100103153847 [0,1,0,0,0,1|1,0,0]=3 3807 B12R1.19 CC(=O)Nc1ccc(c(c1)C)C 11a_100000724040_100015343762 [0,1,0,0,0,1|0,0,0]=2 3808 B12R1.19 CC(=O)Nc1ccc(c(c1)C)C 1626a_100000724040_100015343762 [0,1,0,0,0,1|0,0,0]=2 3809 B12R1.19 CC(=O)Nc1ccc(c(c1)C)C 22a_100000724040_100000070787 [0,1,0,0,0,1|0,0,0]=2 3810 B12R1.19 CC(=O)Nc1ccc(c(c1)C)C 527a_100000724040_100103153847 [0,1,0,0,0,1|0,0,0]=2 3811 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Cl 11a_100000187808_100015343762 [0,1,0,0,0,1|1,0,0]=3 3812 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Cl 1626a_100000187808_100015343762 [0,1,0,0,0,1|1,0,0]=3 3813 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Cl 22a_100000187808_100000070787 [0,1,0,0,0,1|1,0,0]=3 3814 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Cl 527a_100000187808_100103153847 [0,1,0,0,0,1|1,0,0]=3 3815 B12R1.19 CC(=O)Nc1ccc(c(c1)C)F 11a_100000750164_100015343762 [0,1,0,0,0,1|1,0,0]=3 3816 B12R1.19 CC(=O)Nc1ccc(c(c1)C)F 1626a_100000750164_100015343762 [0,1,0,0,0,1|1,0,0]=3 3817 B12R1.19 CC(=O)Nc1ccc(c(c1)C)F 22a_100000750164_100000070787 [0,1,0,0,0,1|1,0,0]=3 3818 B12R1.19 CC(=O)Nc1ccc(c(c1)C)F 527a_100000750164_100103153847 [0,1,0,0,0,1|1,0,0]=3 3819 B12R1.19 CC(=O)Nc1ccc(c(c1)C)I 11a_100000198070_100015343762 [0,1,0,0,0,1|1,0,0]=3 3820 B12R1.19 CC(=O)Nc1ccc(c(c1)C)I 1626a_100000198070_100015343762 [0,1,0,0,0,1|1,0,0]=3 3821 B12R1.19 CC(=O)Nc1ccc(c(c1)C)I 22a_100000198070_100000070787 [0,1,0,0,0,1|1,0,0]=3 3822 B12R1.19 CC(=O)Nc1ccc(c(c1)C)I 527a_100000198070_100103153847 [0,1,0,0,0,1|1,0,0]=3 3823 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 11a_100011218179_100015343762 [0,1,0,0,0,1|1,0,0]=3 3824 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 22a_100011218179_100000070787 [0,1,0,0,0,1|1,0,0]=3 3825 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 271570a_203496583355_100000155607 [0,1,0,0,0,1|1,0,0]=3 3826 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 527a_100011218179_100103153847 [0,1,0,0,0,1|1,0,0]=3 3827 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Br 11a_100000687081_100015343762 [0,1,0,0,0,1|1,0,0]=3 3828 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Br 1626a_100000687081_100015343762 [0,1,0,0,0,1|1,0,0]=3 3829 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Br 22a_100000687081_100000070787 [0,1,0,0,0,1|1,0,0]=3 3830 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Br 527a_100000687081_100103153847 [0,1,0,0,0,1|1,0,0]=3 3831 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)C 11a_100000188892_100015343762 [0,1,0,0,0,1|0,0,0]=2 3832 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)C 1626a_100000188892_100015343762 [0,1,0,0,0,1|0,0,0]=2 3833 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)C 22a_100000188892_100000070787 [0,1,0,0,0,1|0,0,0]=2 3834 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)C 527a_100000188892_100103153847 [0,1,0,0,0,1|0,0,0]=2 3835 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Cl 11a_100000184108_100015343762 [0,1,0,0,0,1|1,0,0]=3 3836 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Cl 1626a_100000184108_100015343762 [0,1,0,0,0,1|1,0,0]=3 3837 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Cl 22a_100000184108_100000070787 [0,1,0,0,0,1|1,0,0]=3 3838 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Cl 527a_100000184108_100103153847 [0,1,0,0,0,1|1,0,0]=3 3839 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)F 11a_100000211060_100015343762 [0,1,0,0,0,1|1,0,0]=3 3840 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)F 1626a_100000211060_100015343762 [0,1,0,0,0,1|1,0,0]=3 3841 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)F 22a_100000211060_100000070787 [0,1,0,0,0,1|1,0,0]=3 3842 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)F 527a_100000211060_100103153847 [0,1,0,0,0,1|1,0,0]=3 3843 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)I 11a_100000761885_100015343762 [0,1,0,0,0,1|1,0,0]=3 3844 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)I 1626a_100000761885_100015343762 [0,1,0,0,0,1|1,0,0]=3 3845 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)I 22a_100000761885_100000070787 [0,1,0,0,0,1|1,0,0]=3 3846 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)O 22a_100000744943_100000070787 [0,1,0,0,0,1|1,0,0]=3 3847 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Br 11a_100000759894_100015343762 [0,1,0,0,0,1|1,0,0]=3 3848 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Br 1626a_100000759894_100015343762 [0,1,0,0,0,1|1,0,0]=3 3849 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Br 22a_100000759894_100000070787 [0,1,0,0,0,1|1,0,0]=3 3850 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Br 527a_100000759894_100103153847 [0,1,0,0,0,1|1,0,0]=3 3851 B12R1.19 CC(=O)Nc1ccc(c(c1)F)C 11a_100000210958_100015343762 [0,1,0,0,0,1|0,0,0]=2 3852 B12R1.19 CC(=O)Nc1ccc(c(c1)F)C 1626a_100000210958_100015343762 [0,1,0,0,0,1|0,0,0]=2 3853 B12R1.19 CC(=O)Nc1ccc(c(c1)F)C 22a_100000210958_100000070787 [0,1,0,0,0,1|0,0,0]=2 3854 B12R1.19 CC(=O)Nc1ccc(c(c1)F)C 527a_100000210958_100103153847 [0,1,0,0,0,1|0,0,0]=2 3855 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Cl 11a_100000739366_100015343762 [0,1,0,0,0,1|1,0,0]=3 3856 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Cl 1626a_100000739366_100015343762 [0,1,0,0,0,1|1,0,0]=3 3857 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Cl 22a_100000739366_100000070787 [0,1,0,0,0,1|1,0,0]=3 3858 B12R1.19 CC(=O)Nc1ccc(c(c1)F)F 11a_100000210724_100015343762 [0,1,0,0,0,1|1,0,0]=3 3859 B12R1.19 CC(=O)Nc1ccc(c(c1)F)F 1626a_100000210724_100015343762 [0,1,0,0,0,1|1,0,0]=3 3860 B12R1.19 CC(=O)Nc1ccc(c(c1)F)F 22a_100000210724_100000070787 [0,1,0,0,0,1|1,0,0]=3 3861 B12R1.19 CC(=O)Nc1ccc(c(c1)F)I 11a_100011356925_100015343762 [0,1,0,0,0,1|1,0,0]=3 3862 B12R1.19 CC(=O)Nc1ccc(c(c1)F)I 1626a_100011356925_100015343762 [0,1,0,0,0,1|1,0,0]=3 3863 B12R1.19 CC(=O)Nc1ccc(c(c1)F)I 22a_100011356925_100000070787 [0,1,0,0,0,1|1,0,0]=3 3864 B12R1.19 CC(=O)Nc1ccc(c(c1)F)O 22a_100011220035_100000070787 [0,1,0,0,0,1|1,0,0]=3 3865 B12R1.19 CC(=O)Nc1ccc(c(c1)F)O 271570a_203496583355_100011219590 [0,1,0,0,0,1|1,0,0]=3 3866 B12R1.19 CC(=O)Nc1ccc(c(c1)F)O 527a_100011220035_100103153847 [0,1,0,0,0,1|1,0,0]=3 3867 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Br 11a_100000750459_100015343762 [0,1,0,0,0,1|1,0,0]=3 3868 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Br 1626a_100000750459_100015343762 [0,1,0,0,0,1|1,0,0]=3 3869 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Br 22a_100000750459_100000070787 [0,1,0,0,0,1|1,0,0]=3 3870 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Br 527a_100000750459_100103153847 [0,1,0,0,0,1|1,0,0]=3 3871 B12R1.19 CC(=O)Nc1ccc(c(c1)I)C 11a_100000184131_100015343762 [0,1,0,0,0,1|0,0,0]=2 3872 B12R1.19 CC(=O)Nc1ccc(c(c1)I)C 1626a_100000184131_100015343762 [0,1,0,0,0,1|0,0,0]=2 3873 B12R1.19 CC(=O)Nc1ccc(c(c1)I)C 22a_100000184131_100000070787 [0,1,0,0,0,1|0,0,0]=2 3874 B12R1.19 CC(=O)Nc1ccc(c(c1)I)C 527a_100000184131_100103153847 [0,1,0,0,0,1|0,0,0]=2 3875 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Cl 11a_100012360549_100015343762 [0,1,0,0,0,1|1,0,0]=3 3876 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Cl 1626a_100012360549_100015343762 [0,1,0,0,0,1|1,0,0]=3 3877 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Cl 22a_100012360549_100000070787 [0,1,0,0,0,1|1,0,0]=3 3878 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Cl 527a_100012360549_100103153847 [0,1,0,0,0,1|1,0,0]=3 3879 B12R1.19 CC(=O)Nc1ccc(c(c1)I)F 11a_114828291077_100015343762 [0,1,0,0,0,1|1,0,0]=3 3880 B12R1.19 CC(=O)Nc1ccc(c(c1)I)F 1626a_114828291077_100015343762 [0,1,0,0,0,1|1,0,0]=3 3881 B12R1.19 CC(=O)Nc1ccc(c(c1)I)F 22a_114828291077_100000070787 [0,1,0,0,0,1|1,0,0]=3 3882 B12R1.19 CC(=O)Nc1ccc(c(c1)I)F 527a_114828291077_100103153847 [0,1,0,0,0,1|1,0,0]=3 3883 B12R1.19 CC(=O)Nc1ccc(c(c1)O)C 11a_100000759471_100015343762 [0,1,0,0,0,1|0,0,0]=2 3884 B12R1.19 CC(=O)Nc1ccc(c(c1)O)C 22a_100000759471_100000070787 [0,1,0,0,0,1|0,0,0]=2 3885 B12R1.19 CC(=O)Nc1ccc(c(c1)O)C 271570a_203496583355_100011221169 [0,1,0,0,0,1|0,0,0]=2 3886 B12R1.19 CC(=O)Nc1ccc(c(c1)O)C 527a_100000759471_100103153847 [0,1,0,0,0,1|0,0,0]=2 3887 B12R1.19 CC(=O)Nc1ccc(c(c1)O)Cl 22a_100011934209_100000070787 [0,1,0,0,0,1|1,0,0]=3 3888 B12R1.19 CC(=O)Nc1ccc(c(c1)O)F 22a_100012017398_100000070787 [0,1,0,0,0,1|1,0,0]=3 3889 B12R1.19 CC(=O)Nc1ccc(c(c1)O)F 271570a_203496583355_100012348134 [0,1,0,0,0,1|1,0,0]=3 3890 B12R1.19 CC(=O)Nc1ccc(c(c1)O)F 527a_100012017398_100103153847 [0,1,0,0,0,1|1,0,0]=3 3891 B12R1.19 CC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000070787 [0,1,0,0,0,1|1,0,0]=3 3892 B12R1.19 CC(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100103153847 [0,1,0,0,0,1|1,0,0]=3 3893 B12R1.19 CC(=O)Nc1ccc(c(n1)C)O 271570a_203496583355_100000187074 [0,1,0,0,0,1|2,0,0]=4 3894 B12R1.19 CC(=O)Nc1ccc(c(n1)F)O 271570a_203496583355_100000050017 [0,1,0,0,0,1|2,0,0]=4 3895 B12R1.19 CC(=O)Oc1ccc(c(c1)O)C 271570a_203496583355_200025702335 [0,1,0,0,0,1|0,0,0]=2 3896 B12R1.19 Cc1cc(ccc1Br)CC(=O)[13CH3] 1458a_100012340274_200025704644 [0,1,0,0,0,1|1,0,0]=3 3897 B12R1.19 Cc1cc(ccc1F)CC(=O)[13CH3] 1458a_100011667458_200025704644 [0,1,0,0,0,1|1,0,0]=3 3898 B12R1.19 Cc1cc(ccc1O)CC(=O)[13CH3] 1458a_100000083968_200025704644 [0,1,0,0,0,1|1,0,0]=3 3899 B12R1.19 Cc1cc(ccc1O)NC(=O)N 271570a_203496583355_100000238934 [0,1,0,0,0,1|2,0,0]=4 3900 B12R1.19 Cc1ccc(cc1Br)CC(=O)[13CH3] 1458a_100000709925_200025704644 [0,1,0,0,0,1|0,0,0]=2 3901 B12R1.19 Cc1ccc(cc1Br)CN(C)C 2230a_100102631434_100012232412 [0,1,0,0,0,1|2,0,0]=4 3902 B12R1.19 Cc1ccc(cc1Br)CN(C)C 269982a_100102631434_100012232412 [0,1,0,0,0,1|2,0,0]=4 3903 B12R1.19 Cc1ccc(cc1Br)CN(C)C 270004a_100102631434_100000695567 [0,1,0,0,0,1|2,0,0]=4 3904 B12R1.19 Cc1ccc(cc1Br)NC(C)C 2230a_100000736455_100000210206 [0,1,0,0,0,1|1,0,1]=4 3905 B12R1.19 Cc1ccc(cc1Br)NC(C)C 34a_100000736455_100000210206 [0,1,0,0,0,1|1,0,1]=4 3906 B12R1.19 Cc1ccc(cc1Br)NC(C)C 7a_100000736455_100000210206 [0,1,0,0,0,1|1,0,1]=4 3907 B12R1.19 Cc1ccc(cc1Br)OC(C)C 34a_100011380479_100000210206 [0,1,0,0,0,1|1,0,1]=4 3908 B12R1.19 Cc1ccc(cc1Br)OC(C)C 7a_100011380479_100000210206 [0,1,0,0,0,1|1,0,1]=4 3909 B12R1.19 Cc1ccc(cc1Br)SC(C)C 62a_100000210206_100011847877 [0,1,0,0,0,1|1,0,1]=4 3910 B12R1.19 Cc1ccc(cc1Br)SC(C)C 62a_100011847877_100000210206 [0,1,0,0,0,1|1,0,1]=4 3911 B12R1.19 Cc1ccc(cc1C)CC(=O)[13CH3] 1458a_100000184070_200025704644 [0,1,0,0,0,1|0,0,0]=2 3912 B12R1.19 Cc1ccc(cc1C)CN(C)C 2230a_100015204808_200000210301 [0,1,0,0,0,1|2,0,0]=4 3913 B12R1.19 Cc1ccc(cc1C)CN(C)C 2230a_100102631434_100000742320 [0,1,0,0,0,1|2,0,0]=4 3914 B12R1.19 Cc1ccc(cc1C)CN(C)C 269982a_100015204808_200000210301 [0,1,0,0,0,1|2,0,0]=4 3915 B12R1.19 Cc1ccc(cc1C)CN(C)C 269982a_100102631434_100000742320 [0,1,0,0,0,1|2,0,0]=4 3916 B12R1.19 Cc1ccc(cc1C)CN(C)C 270004a_100102631434_100000229942 [0,1,0,0,0,1|2,0,0]=4 3917 B12R1.19 Cc1ccc(cc1C)CN(C)C 34a_100015204808_200000210301 [0,1,0,0,0,1|2,0,0]=4 3918 B12R1.19 Cc1ccc(cc1C)CN(C)[13CH3] 2230a_100015204808_200025704644 [0,1,0,0,0,1|2,0,0]=4 3919 B12R1.19 Cc1ccc(cc1C)CN(C)[13CH3] 269982a_100015204808_200025704644 [0,1,0,0,0,1|2,0,0]=4 3920 B12R1.19 Cc1ccc(cc1C)CN(C)[13CH3] 34a_100015204808_200025704644 [0,1,0,0,0,1|2,0,0]=4 3921 B12R1.19 Cc1ccc(cc1C)NC(C)C 2230a_100000724040_100000210206 [0,1,0,0,0,1|1,0,1]=4 3922 B12R1.19 Cc1ccc(cc1C)NC(C)C 34a_100000724040_100000210206 [0,1,0,0,0,1|1,0,1]=4 3923 B12R1.19 Cc1ccc(cc1C)NC(C)C 7a_100000724040_100000210206 [0,1,0,0,0,1|1,0,1]=4 3924 B12R1.19 Cc1ccc(cc1C)OC(C)C 34a_100000210932_100000210206 [0,1,0,0,0,1|1,0,1]=4 3925 B12R1.19 Cc1ccc(cc1C)OC(C)C 7a_100000210932_100000210206 [0,1,0,0,0,1|1,0,1]=4 3926 B12R1.19 Cc1ccc(cc1C)SC(C)C 62a_100000210206_100011215607 [0,1,0,0,0,1|1,0,1]=4 3927 B12R1.19 Cc1ccc(cc1C)SC(C)C 62a_100011215607_100000210206 [0,1,0,0,0,1|1,0,1]=4 3928 B12R1.19 Cc1ccc(cc1Cl)CN(C)C 2230a_100102631434_100011823929 [0,1,0,0,0,1|2,0,0]=4 3929 B12R1.19 Cc1ccc(cc1Cl)CN(C)C 269982a_100102631434_100011823929 [0,1,0,0,0,1|2,0,0]=4 3930 B12R1.19 Cc1ccc(cc1Cl)CN(C)C 270004a_100102631434_100000760539 [0,1,0,0,0,1|2,0,0]=4 3931 B12R1.19 Cc1ccc(cc1Cl)NC(C)C 2230a_100000188892_100000210206 [0,1,0,0,0,1|1,0,1]=4 3932 B12R1.19 Cc1ccc(cc1Cl)NC(C)C 34a_100000188892_100000210206 [0,1,0,0,0,1|1,0,1]=4 3933 B12R1.19 Cc1ccc(cc1Cl)NC(C)C 7a_100000188892_100000210206 [0,1,0,0,0,1|1,0,1]=4 3934 B12R1.19 Cc1ccc(cc1Cl)OC(C)C 34a_100011265682_100000210206 [0,1,0,0,0,1|1,0,1]=4 3935 B12R1.19 Cc1ccc(cc1Cl)OC(C)C 7a_100011265682_100000210206 [0,1,0,0,0,1|1,0,1]=4 3936 B12R1.19 Cc1ccc(cc1Cl)SC(C)C 62a_100000210206_100011216363 [0,1,0,0,0,1|1,0,1]=4 3937 B12R1.19 Cc1ccc(cc1Cl)SC(C)C 62a_100011216363_100000210206 [0,1,0,0,0,1|1,0,1]=4 3938 B12R1.19 Cc1ccc(cc1F)CC(=O)[13CH3] 1458a_100011217375_200025704644 [0,1,0,0,0,1|0,0,0]=2 3939 B12R1.19 Cc1ccc(cc1F)CN(C)C 2230a_100102631434_100011217369 [0,1,0,0,0,1|2,0,0]=4 3940 B12R1.19 Cc1ccc(cc1F)CN(C)C 269982a_100102631434_100011217369 [0,1,0,0,0,1|2,0,0]=4 3941 B12R1.19 Cc1ccc(cc1F)CN(C)C 270004a_100102631434_100000753222 [0,1,0,0,0,1|2,0,0]=4 3942 B12R1.19 Cc1ccc(cc1F)NC(C)C 2230a_100000210958_100000210206 [0,1,0,0,0,1|1,0,1]=4 3943 B12R1.19 Cc1ccc(cc1F)NC(C)C 34a_100000210958_100000210206 [0,1,0,0,0,1|1,0,1]=4 3944 B12R1.19 Cc1ccc(cc1F)NC(C)C 7a_100000210958_100000210206 [0,1,0,0,0,1|1,0,1]=4 3945 B12R1.19 Cc1ccc(cc1F)OC(C)C 34a_100000722560_100000210206 [0,1,0,0,0,1|1,0,1]=4 3946 B12R1.19 Cc1ccc(cc1F)OC(C)C 7a_100000722560_100000210206 [0,1,0,0,0,1|1,0,1]=4 3947 B12R1.19 Cc1ccc(cc1F)SC(C)C 62a_100000210206_100000720648 [0,1,0,0,0,1|1,0,1]=4 3948 B12R1.19 Cc1ccc(cc1F)SC(C)C 62a_100000720648_100000210206 [0,1,0,0,0,1|1,0,1]=4 3949 B12R1.19 Cc1ccc(cc1I)CN(C)C 2230a_100102631434_100010206137 [0,1,0,0,0,1|2,0,0]=4 3950 B12R1.19 Cc1ccc(cc1I)CN(C)C 269982a_100102631434_100010206137 [0,1,0,0,0,1|2,0,0]=4 3951 B12R1.19 Cc1ccc(cc1I)CN(C)C 270004a_100102631434_100010197721 [0,1,0,0,0,1|2,0,0]=4 3952 B12R1.19 Cc1ccc(cc1I)NC(C)C 34a_100000184131_100000210206 [0,1,0,0,0,1|1,0,1]=4 3953 B12R1.19 Cc1ccc(cc1I)NC(C)C 7a_100000184131_100000210206 [0,1,0,0,0,1|1,0,1]=4 3954 B12R1.19 Cc1ccc(cc1N)OC(C)C 34a_100011216113_100000210206 [0,1,0,0,0,1|1,0,1]=4 3955 B12R1.19 Cc1ccc(cc1N)OC(C)C 7a_100011216113_100000210206 [0,1,0,0,0,1|1,0,1]=4 3956 B12R1.19 Cc1ccc(cc1N)SC(C)C 62a_100000210206_100000761890 [0,1,0,0,0,1|1,0,1]=4 3957 B12R1.19 Cc1ccc(cc1N)SC(C)C 62a_100000761890_100000210206 [0,1,0,0,0,1|1,0,1]=4 3958 B12R1.19 Cc1ccc(cc1O)CC(=O)[13CH3] 1458a_100000082272_200025704644 [0,1,0,0,0,1|0,0,0]=2 3959 B12R1.19 Cc1ccc(cc1O)NC(C)C 34a_100000759471_100000210206 [0,1,0,0,0,1|1,0,1]=4 3960 B12R1.19 Cc1ccc(cc1O)NC(C)C 7a_100000759471_100000210206 [0,1,0,0,0,1|1,0,1]=4 3961 B12R1.19 Cc1ccc(cc1O)OC(C)C 271570a_203496583355_200010081138 [0,1,0,0,0,1|1,0,1]=4 3962 B12R1.19 Cc1ccc(cc1O)SC(C)C 62a_100000210206_100000685420 [0,1,0,0,0,1|1,0,1]=4 3963 B12R1.19 Cc1ccc(cc1O)SC(C)C 62a_100000685420_100000210206 [0,1,0,0,0,1|1,0,1]=4 3964 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Br)Cl 1458a_100012349508_200025704644 [0,1,0,0,0,1|1,0,0]=3 3965 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Br)F 1458a_100000742997_200025704644 [0,1,0,0,0,1|1,0,0]=3 3966 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_200025704644 [0,1,0,0,0,1|1,0,0]=3 3967 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000766880_200025704644 [0,1,0,0,0,1|1,0,0]=3 3968 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000210702_200025704644 [0,1,0,0,0,1|1,0,0]=3 3969 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)F 1458a_100011217296_200025704644 [0,1,0,0,0,1|1,0,0]=3 3970 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_200025704644 [0,1,0,0,0,1|1,0,0]=3 3971 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)Br 1458a_100000691132_200025704644 [0,1,0,0,0,1|1,0,0]=3 3972 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)Cl 1458a_100000722404_200025704644 [0,1,0,0,0,1|1,0,0]=3 3973 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)F 1458a_100000684721_200025704644 [0,1,0,0,0,1|1,0,0]=3 3974 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)I 1458a_100010149632_200025704644 [0,1,0,0,0,1|1,0,0]=3 3975 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_200025704644 [0,1,0,0,0,1|1,0,0]=3 3976 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200025704644 [0,1,0,0,0,1|1,0,0]=3 3977 B12R1.20 CC(=C(C)c1ccc(cc1)Br)C 271570a_200000049429_100000752885 [0,1,0,0,0,1|2,0,0]=4 3978 B12R1.20 CC(=C(C)c1ccc(cc1)C)C 271570a_200000049429_100000186775 [0,1,0,0,0,1|1,0,0]=3 3979 B12R1.20 CC(=C(C)c1ccc(cc1)Cl)C 271570a_200000049429_100000755918 [0,1,0,0,0,1|2,0,0]=4 3980 B12R1.20 CC(=C(C)c1ccc(cc1)F)C 271570a_200000049429_100000211213 [0,1,0,0,0,1|2,0,0]=4 3981 B12R1.20 CC(=C(C)c1ccc(cc1)N)C 271570a_200000049429_100000185761 [0,1,0,0,0,1|2,0,0]=4 3982 B12R1.20 CC(=C(C)c1ccc(cc1)O)C 271570a_200000049429_100000185759 [0,1,0,0,0,1|2,0,0]=4 3983 B12R1.20 CC(=C(C)c1ccc(cn1)C)C 271570a_200000049429_100000754016 [0,1,0,0,0,1|2,0,0]=4 3984 B12R1.20 CC(=C(C)c1ccc(nc1)C)C 271570a_200000049429_100000751577 [0,1,0,0,0,1|2,0,0]=4 3985 B12R1.20 CC(=O)C(C)c1ccc(cc1)Br 1458a_100000070787_100000755118 [0,1,0,0,0,1|1,0,0]=3 3986 B12R1.20 CC(=O)C(C)c1ccc(cc1)C 1458a_100000070787_100011261388 [0,1,0,0,0,1|0,0,0]=2 3987 B12R1.20 CC(=O)C(C)c1ccc(cc1)C 1458a_100000751627_200000210301 [0,1,0,0,0,1|0,0,0]=2 3988 B12R1.20 CC(=O)C(C)c1ccc(cc1)Cl 1458a_100000070787_100000684792 [0,1,0,0,0,1|1,0,0]=3 3989 B12R1.20 CC(=O)C(C)c1ccc(cc1)Cl 1458a_100011216001_200000210301 [0,1,0,0,0,1|1,0,0]=3 3990 B12R1.20 CC(=O)C(C)c1ccc(cc1)F 1458a_100000070787_100000743420 [0,1,0,0,0,1|1,0,0]=3 3991 B12R1.20 CC(=O)C(C)c1ccc(cc1)F 1458a_100011435297_200000210301 [0,1,0,0,0,1|1,0,0]=3 3992 B12R1.20 CC(=O)C(C)c1ccc(cc1)O 1458a_100000031422_200000210301 [0,1,0,0,0,1|1,0,0]=3 3993 B12R1.20 CC(=O)C(F)c1ccc(cc1)Cl 1458a_100012277543_200000210301 [0,1,0,0,0,1|1,0,0]=3 3994 B12R1.20 CC(=O)C(O)c1ccc(cc1)Br 1458a_100000756554_200000210301 [0,1,0,0,0,1|1,0,0]=3 3995 B12R1.20 CC(=O)C(O)c1ccc(cc1)F 1458a_100000209909_200000210301 [0,1,0,0,0,1|1,0,0]=3 3996 B12R1.20 CC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_200000210301 [0,1,0,0,0,1|1,0,0]=3 3997 B12R1.20 CC(=O)N(C)c1ccc(cc1)Br 11a_100000219623_100015343762 [0,1,0,0,0,1|1,0,0]=3 3998 B12R1.20 CC(=O)N(C)c1ccc(cc1)Br 1626a_100000219623_100015343762 [0,1,0,0,0,1|1,0,0]=3 3999 B12R1.20 CC(=O)N(C)c1ccc(cc1)Br 22a_100000219623_100000070787 [0,1,0,0,0,1|1,0,0]=3 4000 B12R1.20 CC(=O)N(C)c1ccc(cc1)C 11a_100000219977_100015343762 [0,1,0,0,0,1|0,0,0]=2 4001 B12R1.20 CC(=O)N(C)c1ccc(cc1)C 1626a_100000219977_100015343762 [0,1,0,0,0,1|0,0,0]=2 4002 B12R1.20 CC(=O)N(C)c1ccc(cc1)C 22a_100000219977_100000070787 [0,1,0,0,0,1|0,0,0]=2 4003 B12R1.20 CC(=O)N(C)c1ccc(cc1)Cl 11a_100020629279_100015343762 [0,1,0,0,0,1|1,0,0]=3 4004 B12R1.20 CC(=O)N(C)c1ccc(cc1)Cl 1626a_100020629279_100015343762 [0,1,0,0,0,1|1,0,0]=3 4005 B12R1.20 CC(=O)N(C)c1ccc(cc1)Cl 22a_100020629279_100000070787 [0,1,0,0,0,1|1,0,0]=3 4006 B12R1.20 CC(=O)N(C)c1ccc(cc1)F 11a_100000219829_100015343762 [0,1,0,0,0,1|1,0,0]=3 4007 B12R1.20 CC(=O)N(C)c1ccc(cc1)F 1626a_100000219829_100015343762 [0,1,0,0,0,1|1,0,0]=3 4008 B12R1.20 CC(=O)N(C)c1ccc(cc1)F 22a_100000219829_100000070787 [0,1,0,0,0,1|1,0,0]=3 4009 B12R1.20 CC(=O)N(C)c1ccc(cc1)I 11a_100000743151_100015343762 [0,1,0,0,0,1|1,0,0]=3 4010 B12R1.20 CC(=O)N(C)c1ccc(cc1)I 1626a_100000743151_100015343762 [0,1,0,0,0,1|1,0,0]=3 4011 B12R1.20 CC(=O)N(C)c1ccc(cc1)I 22a_100000743151_100000070787 [0,1,0,0,0,1|1,0,0]=3 4012 B12R1.20 CC(=O)N(C)c1ccc(cc1)O 22a_100000182112_100000070787 [0,1,0,0,0,1|1,0,0]=3 4013 B12R1.20 CC(=O)N(C)c1ccc(cc1)O 271570a_203496583355_200009816415 [0,1,0,0,0,1|1,0,0]=3 4014 B12R1.20 CC(=O)N(C)c1ccc(cc1)O 527a_100000182112_100103153847 [0,1,0,0,0,1|1,0,0]=3 4015 B12R1.20 CC(=O)[C@H](O)c1ccc(cc1)C 1458a_100009815954_200000210301 [0,1,0,0,0,1|0,0,0]=2 4016 B12R1.20 CC(=O)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_200000210301 [0,1,0,0,0,1|1,0,0]=3 4017 B12R1.20 CC(C(=O)[13CH3])c1ccc(cc1)Cl 1458a_100011216001_200025704644 [0,1,0,0,0,1|1,0,0]=3 4018 B12R1.20 CC(C(=O)[13CH3])c1ccc(cc1)F 1458a_100011435297_200025704644 [0,1,0,0,0,1|1,0,0]=3 4019 B12R1.20 CC(C(=O)[13CH3])c1ccc(cc1)O 1458a_100000031422_200025704644 [0,1,0,0,0,1|1,0,0]=3 4020 B12R1.20 Cc1ccc(cc1)C(=O)C(C)C 1458a_100000188618_100000210206 [0,1,0,0,0,1|1,0,1]=4 4021 B12R1.20 Cc1ccc(cc1)C(=O)N(C)C 11a_100102631434_100000188618 [0,1,0,0,0,1|2,0,0]=4 4022 B12R1.20 Cc1ccc(cc1)C(=O)N(C)C 1626a_100102631434_100000188618 [0,1,0,0,0,1|2,0,0]=4 4023 B12R1.20 Cc1ccc(cc1)C(=O)N(C)C 240690a_100102631434_100000188618 [0,1,0,0,0,1|2,0,0]=4 4024 B12R1.20 Cc1ccc(cc1)C(=O)N(C)C 527a_100102631434_100000188618 [0,1,0,0,0,1|2,0,0]=4 4025 B12R1.20 Cc1ccc(cc1)C(C)C(=O)[13CH3] 1458a_100000751627_200025704644 [0,1,0,0,0,1|0,0,0]=2 4026 B12R1.20 Cc1ccc(cc1)C(C)N(C)C 2230a_100102631434_100011261388 [0,1,0,0,0,1|2,0,0]=4 4027 B12R1.20 Cc1ccc(cc1)C(C)N(C)C 269982a_100102631434_100011261388 [0,1,0,0,0,1|2,0,0]=4 4028 B12R1.20 Cc1ccc(cc1)N(C)C(C)C 2230a_100000219977_100000210206 [0,1,0,0,0,1|1,0,1]=4 4029 B12R1.20 Cc1ccc(cc1)N(C)C(C)C 2230a_100000748792_200000210301 [0,1,0,0,0,1|1,0,1]=4 4030 B12R1.20 Cc1ccc(cc1)N(C)C(C)C 269982a_100000219977_100000210206 [0,1,0,0,0,1|1,0,1]=4 4031 B12R1.20 Cc1ccc(cc1)N(C)C(C)C 269982a_100000748792_200000210301 [0,1,0,0,0,1|1,0,1]=4 4032 B12R1.20 Cc1ccc(cc1)N(C)C(C)C 34a_100000219977_100000210206 [0,1,0,0,0,1|1,0,1]=4 4033 B12R1.20 Cc1ccc(cc1)N(C)C(C)C 34a_100000748792_200000210301 [0,1,0,0,0,1|1,0,1]=4 4034 B12R1.20 Cc1ccc(cc1)N(C)C(C)C 7a_100000748792_200000210301 [0,1,0,0,0,1|1,0,1]=4 4035 B12R1.20 Cc1ccc(cc1)N([13CH3])C(C)C 2230a_100000748792_200025704644 [0,1,0,0,0,1|1,0,1]=4 4036 B12R1.20 Cc1ccc(cc1)N([13CH3])C(C)C 269982a_100000748792_200025704644 [0,1,0,0,0,1|1,0,1]=4 4037 B12R1.20 Cc1ccc(cc1)N([13CH3])C(C)C 34a_100000748792_200025704644 [0,1,0,0,0,1|1,0,1]=4 4038 B12R1.20 Cc1ccc(cc1)N([13CH3])C(C)C 7a_100000748792_200025704644 [0,1,0,0,0,1|1,0,1]=4 4039 B12R1.20 Cc1ccc(cc1)[C@@H](O)C(=O)[13CH3] 1458a_100009815954_200025704644 [0,1,0,0,0,1|0,0,0]=2 4040 B12R1.20 NC(=O)C(=O)c1ccc(cc1)O 271570a_203496583355_200009822167 [0,1,0,0,0,1|2,0,0]=4 4041 B12R1.20 [13CH3]C(=O)C(F)c1ccc(cc1)Cl 1458a_100012277543_200025704644 [0,1,0,0,0,1|1,0,0]=3 4042 B12R1.20 [13CH3]C(=O)C(O)c1ccc(cc1)Br 1458a_100000756554_200025704644 [0,1,0,0,0,1|1,0,0]=3 4043 B12R1.20 [13CH3]C(=O)C(O)c1ccc(cc1)F 1458a_100000209909_200025704644 [0,1,0,0,0,1|1,0,0]=3 4044 B12R1.20 [13CH3]C(=O)C(O)c1ccc(cc1)O 1458a_100011215213_200025704644 [0,1,0,0,0,1|1,0,0]=3 4045 B12R1.20 [13CH3]C(=O)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_200025704644 [0,1,0,0,0,1|1,0,0]=3 4046 B12R1.49 C#CC(=O)Cc1ccc(cc1)Br 1458a_100000211873_100000189115 [0,1,0,0,0,1|1,0,1]=4 4047 B12R1.49 C#CC(=O)Cc1ccc(cc1)C 1458a_100000211873_100000210814 [0,1,0,0,0,1|0,0,1]=3 4048 B12R1.49 C#CC(=O)Cc1ccc(cc1)Cl 1458a_100000211873_100000694040 [0,1,0,0,0,1|1,0,1]=4 4049 B12R1.49 C#CC(=O)Cc1ccc(cc1)F 1458a_100000211873_100000198546 [0,1,0,0,0,1|1,0,1]=4 4050 B12R1.49 C#CC(=O)Cc1ccc(cc1)I 1458a_100000211873_100000189116 [0,1,0,0,0,1|1,0,1]=4 4051 B12R1.49 C#CC(=O)Cc1ccc(cn1)C 1458a_100000211873_100000691093 [0,1,0,0,0,1|1,0,1]=4 4052 B12R1.49 C#CC(=O)Cc1ccc(nc1)C 1458a_100000211873_100016987292 [0,1,0,0,0,1|1,0,1]=4 4053 B12R1.49 C#CC(C)Nc1ccc(cc1)C 34a_100000124888_200000035995 [0,1,0,0,0,1|1,0,1]=4 4054 B12R1.49 C#CC(C)Oc1ccc(cc1)C 34a_100000210336_200000035995 [0,1,0,0,0,1|1,0,1]=4 4055 B12R1.49 C#CC(C)Sc1ccc(cc1)C 62a_200000035995_100000186775 [0,1,0,0,0,1|1,0,1]=4 4056 B12R1.49 C=CC(=O)Cc1ccc(cc1)Br 1458a_100000185746_100000189115 [0,1,0,0,0,1|1,0,1]=4 4057 B12R1.49 C=CC(=O)Cc1ccc(cc1)C 1458a_100000185746_100000210814 [0,1,0,0,0,1|0,0,1]=3 4058 B12R1.49 C=CC(=O)Cc1ccc(cc1)Cl 1458a_100000185746_100000694040 [0,1,0,0,0,1|1,0,1]=4 4059 B12R1.49 C=CC(=O)Cc1ccc(cc1)F 1458a_100000185746_100000198546 [0,1,0,0,0,1|1,0,1]=4 4060 B12R1.49 C=CC(=O)Cc1ccc(cc1)I 1458a_100000185746_100000189116 [0,1,0,0,0,1|1,0,1]=4 4061 B12R1.49 C=CC(=O)Cc1ccc(cn1)C 1458a_100000185746_100000691093 [0,1,0,0,0,1|1,0,1]=4 4062 B12R1.49 C=CC(=O)Cc1ccc(nc1)C 1458a_100000185746_100016987292 [0,1,0,0,0,1|1,0,1]=4 4063 B12R1.49 C=CC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000185746 [0,1,0,0,0,1|1,0,1]=4 4064 B12R1.49 C=CC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000185746 [0,1,0,0,0,1|1,0,1]=4 4065 B12R1.49 C=CC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000185746 [0,1,0,0,0,1|0,0,1]=3 4066 B12R1.49 C=CC(=O)Nc1ccc(cc1)C 22a_100000124888_100000185746 [0,1,0,0,0,1|0,0,1]=3 4067 B12R1.49 C=CC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000185746 [0,1,0,0,0,1|1,0,1]=4 4068 B12R1.49 C=CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000185746 [0,1,0,0,0,1|1,0,1]=4 4069 B12R1.49 C=CC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000185746 [0,1,0,0,0,1|1,0,1]=4 4070 B12R1.49 C=CC(=O)Nc1ccc(cc1)F 22a_100000185862_100000185746 [0,1,0,0,0,1|1,0,1]=4 4071 B12R1.49 C=CC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000185746 [0,1,0,0,0,1|1,0,1]=4 4072 B12R1.49 C=CC(=O)Nc1ccc(cc1)I 22a_100000185761_100000185746 [0,1,0,0,0,1|1,0,1]=4 4073 B12R1.49 C=CC(=O)Nc1ccc(cc1)O 22a_100000185829_100000185746 [0,1,0,0,0,1|1,0,1]=4 4074 B12R1.49 C=CC(C)Sc1ccc(cc1)C 62a_100011215867_100000186775 [0,1,0,0,0,1|1,0,1]=4 4075 B12R1.49 CC(=Cc1ccc(cc1)Br)C#N 6a_100000186029_200000212204 [0,1,0,0,0,1|2,0,0]=4 4076 B12R1.49 CC(=Cc1ccc(cc1)F)C#N 6a_100000210084_200000212204 [0,1,0,0,0,1|2,0,0]=4 4077 B12R1.49 CC(=Cc1ccc(cc1)I)C#N 6a_100000188517_200000212204 [0,1,0,0,0,1|2,0,0]=4 4078 B12R1.49 CCC(=O)Cc1ccc(cc1)Br 1458a_100000198978_100000210202 [0,1,0,0,0,1|1,0,0]=3 4079 B12R1.49 CCC(=O)Cc1ccc(cc1)Br 1458a_100000210414_100000189115 [0,1,0,0,0,1|1,0,0]=3 4080 B12R1.49 CCC(=O)Cc1ccc(cc1)C 1458a_100000210414_100000210814 [0,1,0,0,0,1|0,0,0]=2 4081 B12R1.49 CCC(=O)Cc1ccc(cc1)C 1458a_100000212244_100000210202 [0,1,0,0,0,1|0,0,0]=2 4082 B12R1.49 CCC(=O)Cc1ccc(cc1)Cl 1458a_100000210414_100000694040 [0,1,0,0,0,1|1,0,0]=3 4083 B12R1.49 CCC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_100000210202 [0,1,0,0,0,1|1,0,0]=3 4084 B12R1.49 CCC(=O)Cc1ccc(cc1)F 1458a_100000210414_100000198546 [0,1,0,0,0,1|1,0,0]=3 4085 B12R1.49 CCC(=O)Cc1ccc(cc1)F 1458a_100000210951_100000210202 [0,1,0,0,0,1|1,0,0]=3 4086 B12R1.49 CCC(=O)Cc1ccc(cc1)I 1458a_100000210414_100000189116 [0,1,0,0,0,1|1,0,0]=3 4087 B12R1.49 CCC(=O)Cc1ccc(cc1)I 1458a_100000688869_100000210202 [0,1,0,0,0,1|1,0,0]=3 4088 B12R1.49 CCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000210202 [0,1,0,0,0,1|1,0,0]=3 4089 B12R1.49 CCC(=O)Cc1ccc(cn1)Br 1458a_100000210414_100000702658 [0,1,0,0,0,1|2,0,0]=4 4090 B12R1.49 CCC(=O)Cc1ccc(cn1)Br 1458a_100020629044_100000210202 [0,1,0,0,0,1|2,0,0]=4 4091 B12R1.49 CCC(=O)Cc1ccc(cn1)C 1458a_100000210414_100000691093 [0,1,0,0,0,1|1,0,0]=3 4092 B12R1.49 CCC(=O)Cc1ccc(cn1)C 1458a_100025705728_100000210202 [0,1,0,0,0,1|1,0,0]=3 4093 B12R1.49 CCC(=O)Cc1ccc(cn1)Cl 1458a_100000210414_100012066911 [0,1,0,0,0,1|2,0,0]=4 4094 B12R1.49 CCC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_100000210202 [0,1,0,0,0,1|2,0,0]=4 4095 B12R1.49 CCC(=O)Cc1ccc(cn1)F 1458a_100000210414_100000703193 [0,1,0,0,0,1|2,0,0]=4 4096 B12R1.49 CCC(=O)Cc1ccc(nc1)Br 1458a_100000210414_100009831999 [0,1,0,0,0,1|2,0,0]=4 4097 B12R1.49 CCC(=O)Cc1ccc(nc1)Br 1458a_100010067268_100000210202 [0,1,0,0,0,1|2,0,0]=4 4098 B12R1.49 CCC(=O)Cc1ccc(nc1)C 1458a_100000210414_100016987292 [0,1,0,0,0,1|1,0,0]=3 4099 B12R1.49 CCC(=O)Cc1ccc(nc1)C 1458a_100000740413_100000210202 [0,1,0,0,0,1|1,0,0]=3 4100 B12R1.49 CCC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_100000210202 [0,1,0,0,0,1|2,0,0]=4 4101 B12R1.49 CCC(=O)Cc1ccc(nc1)Cl 1458a_100000210414_100000735431 [0,1,0,0,0,1|2,0,0]=4 4102 B12R1.49 CCC(=O)Cc1ccc(nc1)F 1458a_100000210414_100009820150 [0,1,0,0,0,1|2,0,0]=4 4103 B12R1.49 CCC(=O)Cc1cnc(cn1)C 1458a_100000210414_100000752025 [0,1,0,0,0,1|2,0,0]=4 4104 B12R1.49 CCC(=O)Cc1ncc(cn1)C 1458a_100000210414_100000685645 [0,1,0,0,0,1|2,0,0]=4 4105 B12R1.49 CCC(=O)Cn1ccc(=O)cc1 1458a_200000238563_100000210202 [0,1,0,0,0,1|2,0,0]=4 4106 B12R1.49 CCC(=O)Nc1ccc(cc1)Br 11a_100000210018_100000210414 [0,1,0,0,0,1|1,0,0]=3 4107 B12R1.49 CCC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000210414 [0,1,0,0,0,1|1,0,0]=3 4108 B12R1.49 CCC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000210414 [0,1,0,0,0,1|1,0,0]=3 4109 B12R1.49 CCC(=O)Nc1ccc(cc1)Br 527a_100000210018_100000210414 [0,1,0,0,0,1|1,0,0]=3 4110 B12R1.49 CCC(=O)Nc1ccc(cc1)C 11a_100000124888_100000210414 [0,1,0,0,0,1|0,0,0]=2 4111 B12R1.49 CCC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000210414 [0,1,0,0,0,1|0,0,0]=2 4112 B12R1.49 CCC(=O)Nc1ccc(cc1)C 22a_100000124888_100000210414 [0,1,0,0,0,1|0,0,0]=2 4113 B12R1.49 CCC(=O)Nc1ccc(cc1)C 527a_100000124888_100000210414 [0,1,0,0,0,1|0,0,0]=2 4114 B12R1.49 CCC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000210414 [0,1,0,0,0,1|1,0,0]=3 4115 B12R1.49 CCC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000210414 [0,1,0,0,0,1|1,0,0]=3 4116 B12R1.49 CCC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000210414 [0,1,0,0,0,1|1,0,0]=3 4117 B12R1.49 CCC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000210414 [0,1,0,0,0,1|1,0,0]=3 4118 B12R1.49 CCC(=O)Nc1ccc(cc1)F 11a_100000185862_100000210414 [0,1,0,0,0,1|1,0,0]=3 4119 B12R1.49 CCC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000210414 [0,1,0,0,0,1|1,0,0]=3 4120 B12R1.49 CCC(=O)Nc1ccc(cc1)F 22a_100000185862_100000210414 [0,1,0,0,0,1|1,0,0]=3 4121 B12R1.49 CCC(=O)Nc1ccc(cc1)F 527a_100000185862_100000210414 [0,1,0,0,0,1|1,0,0]=3 4122 B12R1.49 CCC(=O)Nc1ccc(cc1)I 11a_100000185761_100000210414 [0,1,0,0,0,1|1,0,0]=3 4123 B12R1.49 CCC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000210414 [0,1,0,0,0,1|1,0,0]=3 4124 B12R1.49 CCC(=O)Nc1ccc(cc1)I 22a_100000185761_100000210414 [0,1,0,0,0,1|1,0,0]=3 4125 B12R1.49 CCC(=O)Nc1ccc(cc1)I 527a_100000185761_100000210414 [0,1,0,0,0,1|1,0,0]=3 4126 B12R1.49 CCC(=O)Nc1ccc(cc1)O 22a_100000185829_100000210414 [0,1,0,0,0,1|1,0,0]=3 4127 B12R1.49 CCC(=O)Oc1ccc(cc1)O 271570a_203496583355_200009811598 [0,1,0,0,0,1|1,0,0]=3 4128 B12R1.49 CCC(C)Nc1ccc(cc1)C 34a_100000124888_100011215416 [0,1,0,0,0,1|1,0,1]=4 4129 B12R1.49 CCC(C)Oc1ccc(cc1)C 34a_100000210336_100011215416 [0,1,0,0,0,1|1,0,1]=4 4130 B12R1.49 CCC(C)Oc1ccc(cc1)C 7a_100000210336_100000758301 [0,1,0,0,0,1|1,0,1]=4 4131 B12R1.49 CCC(C)Sc1ccc(cc1)C 62a_100000186775_100000758301 [0,1,0,0,0,1|1,0,1]=4 4132 B12R1.49 CCC(C)Sc1ccc(cc1)C 62a_100000758301_100000186775 [0,1,0,0,0,1|1,0,1]=4 4133 B12R1.49 CCN(C)Cc1ccc(cc1)C 2230a_100000180869_200000210301 [0,1,0,0,0,1|2,0,0]=4 4134 B12R1.49 CCN(C)Cc1ccc(cc1)C 2230a_100000225621_100000210814 [0,1,0,0,0,1|2,0,0]=4 4135 B12R1.49 CCN(C)Cc1ccc(cc1)C 2230a_100000744650_100000210202 [0,1,0,0,0,1|2,0,0]=4 4136 B12R1.49 CCN(C)Cc1ccc(cc1)C 269982a_100000180869_200000210301 [0,1,0,0,0,1|2,0,0]=4 4137 B12R1.49 CCN(C)Cc1ccc(cc1)C 269982a_100000225621_100000210814 [0,1,0,0,0,1|2,0,0]=4 4138 B12R1.49 CCN(C)Cc1ccc(cc1)C 269982a_100000744650_100000204670 [0,1,0,0,0,1|2,0,0]=4 4139 B12R1.49 CCN(C)Cc1ccc(cc1)C 26a_100000225621_200020625495 [0,1,0,0,0,1|2,0,0]=4 4140 B12R1.49 CCN(C)Cc1ccc(cc1)C 34a_100000744650_100000210202 [0,1,0,0,0,1|2,0,0]=4 4141 B12R1.49 CCN([13CH3])Cc1ccc(cc1)C 2230a_100000180869_200025704644 [0,1,0,0,0,1|2,0,0]=4 4142 B12R1.49 CCN([13CH3])Cc1ccc(cc1)C 269982a_100000180869_200025704644 [0,1,0,0,0,1|2,0,0]=4 4143 B12R1.49 CNC(=O)Cc1ccc(cc1)Br 11a_106832991635_100000198978 [0,1,0,0,0,1|1,0,0]=3 4144 B12R1.49 CNC(=O)Cc1ccc(cc1)Br 240690a_100102657272_100000198978 [0,1,0,0,0,1|1,0,0]=3 4145 B12R1.49 CNC(=O)Cc1ccc(cc1)Br 527a_100102657272_100000198978 [0,1,0,0,0,1|1,0,0]=3 4146 B12R1.49 CNC(=O)Cc1ccc(cc1)C 11a_106832991635_100000212244 [0,1,0,0,0,1|0,0,0]=2 4147 B12R1.49 CNC(=O)Cc1ccc(cc1)C 240690a_100102657272_100000212244 [0,1,0,0,0,1|0,0,0]=2 4148 B12R1.49 CNC(=O)Cc1ccc(cc1)C 527a_100102657272_100000212244 [0,1,0,0,0,1|0,0,0]=2 4149 B12R1.49 CNC(=O)Cc1ccc(cc1)Cl 11a_106832991635_100000211027 [0,1,0,0,0,1|1,0,0]=3 4150 B12R1.49 CNC(=O)Cc1ccc(cc1)Cl 240690a_100102657272_100000211027 [0,1,0,0,0,1|1,0,0]=3 4151 B12R1.49 CNC(=O)Cc1ccc(cc1)Cl 527a_100102657272_100000211027 [0,1,0,0,0,1|1,0,0]=3 4152 B12R1.49 CNC(=O)Cc1ccc(cc1)F 11a_106832991635_100000210951 [0,1,0,0,0,1|1,0,0]=3 4153 B12R1.49 CNC(=O)Cc1ccc(cc1)F 1626a_100102657272_100000210951 [0,1,0,0,0,1|1,0,0]=3 4154 B12R1.49 CNC(=O)Cc1ccc(cc1)F 240690a_100102657272_100000210951 [0,1,0,0,0,1|1,0,0]=3 4155 B12R1.49 CNC(=O)Cc1ccc(cc1)F 527a_100102657272_100000210951 [0,1,0,0,0,1|1,0,0]=3 4156 B12R1.49 CNC(=O)Cc1ccc(cc1)I 11a_106832991635_100000688869 [0,1,0,0,0,1|1,0,0]=3 4157 B12R1.49 CNC(=O)Cc1ccc(cc1)I 1626a_100102657272_100000688869 [0,1,0,0,0,1|1,0,0]=3 4158 B12R1.49 CNC(=O)Cc1ccc(cc1)I 240690a_100102657272_100000688869 [0,1,0,0,0,1|1,0,0]=3 4159 B12R1.49 CNC(=O)Cc1ccc(cc1)I 527a_100102657272_100000688869 [0,1,0,0,0,1|1,0,0]=3 4160 B12R1.49 CNC(=O)Cc1ccc(cc1)O 1626a_100102657272_100000198540 [0,1,0,0,0,1|1,0,0]=3 4161 B12R1.49 CNC(=O)Cc1ccc(cc1)O 240690a_100102657272_100000198540 [0,1,0,0,0,1|1,0,0]=3 4162 B12R1.49 CNC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000155101 [0,1,0,0,0,1|1,0,0]=3 4163 B12R1.49 CNC(=O)Cc1ccc(cc1)O 527a_100102657272_100000198540 [0,1,0,0,0,1|1,0,0]=3 4164 B12R1.49 CNC(=O)Cc1ccc(cn1)Br 11a_106832991635_100020629044 [0,1,0,0,0,1|2,0,0]=4 4165 B12R1.49 CNC(=O)Cc1ccc(cn1)Br 240690a_100102657272_100020629044 [0,1,0,0,0,1|2,0,0]=4 4166 B12R1.49 CNC(=O)Cc1ccc(cn1)C 11a_106832991635_100025705728 [0,1,0,0,0,1|1,0,0]=3 4167 B12R1.49 CNC(=O)Cc1ccc(cn1)C 1626a_100102657272_100025705728 [0,1,0,0,0,1|1,0,0]=3 4168 B12R1.49 CNC(=O)Cc1ccc(cn1)C 240690a_100102657272_100025705728 [0,1,0,0,0,1|1,0,0]=3 4169 B12R1.49 CNC(=O)Cc1ccc(cn1)Cl 11a_106832991635_100000728320 [0,1,0,0,0,1|2,0,0]=4 4170 B12R1.49 CNC(=O)Cc1ccc(cn1)Cl 1626a_100102657272_100000728320 [0,1,0,0,0,1|2,0,0]=4 4171 B12R1.49 CNC(=O)Cc1ccc(cn1)Cl 240690a_100102657272_100000728320 [0,1,0,0,0,1|2,0,0]=4 4172 B12R1.49 CNC(=O)Cc1ccc(cn1)Cl 527a_100102657272_100000728320 [0,1,0,0,0,1|2,0,0]=4 4173 B12R1.49 CNC(=O)Cc1ccc(nc1)Br 11a_106832991635_100010067268 [0,1,0,0,0,1|2,0,0]=4 4174 B12R1.49 CNC(=O)Cc1ccc(nc1)Br 240690a_100102657272_100010067268 [0,1,0,0,0,1|2,0,0]=4 4175 B12R1.49 CNC(=O)Cc1ccc(nc1)Br 527a_100102657272_100010067268 [0,1,0,0,0,1|2,0,0]=4 4176 B12R1.49 CNC(=O)Cc1ccc(nc1)C 11a_106832991635_100000740413 [0,1,0,0,0,1|1,0,0]=3 4177 B12R1.49 CNC(=O)Cc1ccc(nc1)C 1626a_100102657272_100000740413 [0,1,0,0,0,1|1,0,0]=3 4178 B12R1.49 CNC(=O)Cc1ccc(nc1)C 240690a_100102657272_100000740413 [0,1,0,0,0,1|1,0,0]=3 4179 B12R1.49 CNC(=O)Cc1ccc(nc1)C 527a_100102657272_100000740413 [0,1,0,0,0,1|1,0,0]=3 4180 B12R1.49 CNC(=O)Cc1ccc(nc1)Cl 11a_106832991635_100000061944 [0,1,0,0,0,1|2,0,0]=4 4181 B12R1.49 CNC(=O)Cc1ccc(nc1)Cl 1626a_100102657272_100000061944 [0,1,0,0,0,1|2,0,0]=4 4182 B12R1.49 CNC(=O)Cc1ccc(nc1)Cl 240690a_100102657272_100000061944 [0,1,0,0,0,1|2,0,0]=4 4183 B12R1.49 CNC(=O)Cc1ccc(nc1)Cl 527a_100102657272_100000061944 [0,1,0,0,0,1|2,0,0]=4 4184 B12R1.49 CNC(=O)Cn1ccc(=O)cc1 11a_106832991635_200000238563 [0,1,0,0,0,1|2,0,0]=4 4185 B12R1.49 CNC(=O)Cn1ccc(=O)cc1 1626a_100102657272_200000238563 [0,1,0,0,0,1|2,0,0]=4 4186 B12R1.49 CNC(=O)Cn1ccc(=O)cc1 240690a_100102657272_200000238563 [0,1,0,0,0,1|2,0,0]=4 4187 B12R1.49 CNC(=O)Cn1ccc(=O)cc1 527a_100102657272_200000238563 [0,1,0,0,0,1|2,0,0]=4 4188 B12R1.49 CNC(=O)Nc1ccc(cc1)Br 2430a_100000210018_100102657272 [0,1,0,0,0,1|1,0,0]=3 4189 B12R1.49 CNC(=O)Nc1ccc(cc1)C 2430a_100000124888_100102657272 [0,1,0,0,0,1|0,0,0]=2 4190 B12R1.49 CNC(=O)Nc1ccc(cc1)Cl 2430a_100000210052_100102657272 [0,1,0,0,0,1|1,0,0]=3 4191 B12R1.49 CNC(=O)Nc1ccc(cc1)F 2430a_100000185862_100102657272 [0,1,0,0,0,1|1,0,0]=3 4192 B12R1.49 CNC(=O)Nc1ccc(cc1)I 2430a_100000185761_100102657272 [0,1,0,0,0,1|1,0,0]=3 4193 B12R1.49 CNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100102657272 [0,1,0,0,0,1|1,0,0]=3 4194 B12R1.49 CNC(C)Cc1ccc(cc1)C 270004a_106832991635_100000751045 [0,1,0,0,0,1|1,0,1]=4 4195 B12R1.49 COC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000149743 [0,1,0,0,0,1|1,0,0]=3 4196 B12R1.49 COC(=O)Cc1ccc(cn1)O 271570a_203496583355_100012362609 [0,1,0,0,0,1|2,0,0]=4 4197 B12R1.49 COC(=O)Cc1ccc(nc1)O 271570a_203496583355_100000071674 [0,1,0,0,0,1|2,0,0]=4 4198 B12R1.49 COC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000181880 [0,1,0,0,0,1|1,0,0]=3 4199 B12R1.49 COC(=O)Nc1ccc(cn1)O 271570a_203496583355_100000188976 [0,1,0,0,0,1|2,0,0]=4 4200 B12R1.49 COC(C)Sc1ccc(cc1)C 62a_100000186775_100009879195 [0,1,0,0,0,1|0,0,2]=4 4201 B12R1.49 COC(C)Sc1ccc(cc1)C 62a_100009879195_100000186775 [0,1,0,0,0,1|0,0,2]=4 4202 B12R1.49 Cc1ccc(cc1)CC(=O)CF 1458a_100000212244_100015361967 [0,1,0,0,0,1|0,0,0]=2 4203 B12R1.49 Cc1ccc(cc1)CC(=O)CO 1458a_100000210174_100000210814 [0,1,0,0,0,1|0,0,0]=2 4204 B12R1.49 Cc1ccc(cc1)CN(C)CF 269982a_100000744650_100015361967 [0,1,0,0,0,1|2,0,0]=4 4205 B12R1.49 Cc1ccc(cc1)CN(C)CF 34a_100000744650_100015361967 [0,1,0,0,0,1|2,0,0]=4 4206 B12R1.49 Cc1ccc(cc1)NC(=O)CO 22a_100000124888_100000210174 [0,1,0,0,0,1|0,0,0]=2 4207 B12R1.49 Cc1ccc(cc1)NC(=O)CO 527a_100000124888_100000210174 [0,1,0,0,0,1|0,0,0]=2 4208 B12R1.49 Cc1ccc(cc1)NC(C)CO 34a_100000124888_100012180447 [0,1,0,0,0,1|0,0,2]=4 4209 B12R1.49 Cc1ccc(cc1)OC(C)C#N 7a_100000210336_100000703298 [0,1,0,0,0,1|1,0,1]=4 4210 B12R1.49 Cc1ccc(cc1)OC(C)CO 34a_100000210336_100012180447 [0,1,0,0,0,1|0,0,2]=4 4211 B12R1.49 Cc1ccc(cc1)OC(C)CO 7a_100000210336_100012180447 [0,1,0,0,0,1|0,0,2]=4 4212 B12R1.49 Cc1ccc(cc1)SC(C)C#N 62a_100000186775_100000703298 [0,1,0,0,0,1|1,0,1]=4 4213 B12R1.49 Cc1ccc(cc1)SC(C)C#N 62a_100000703298_100000186775 [0,1,0,0,0,1|1,0,1]=4 4214 B12R1.49 Cc1ccc(cc1)SC(C)CO 62a_100012180447_100000186775 [0,1,0,0,0,1|0,0,2]=4 4215 B12R1.49 Cc1ccc(cc1)S[C@H](C)CO 62a_100000186775_100016084084 [0,1,0,0,0,1|0,0,2]=4 4216 B12R1.49 Cc1ccc(cc1)S[C@H](C)CO 62a_100016084084_100000186775 [0,1,0,0,0,1|0,0,2]=4 4217 B12R1.49 Cc1ccc(cn1)CC(=O)CF 1458a_100000740413_100015361967 [0,1,0,0,0,1|1,0,0]=3 4218 B12R1.49 Cc1ccc(cn1)CC(=O)CO 1458a_100000210174_100016987292 [0,1,0,0,0,1|1,0,0]=3 4219 B12R1.49 Cc1ccc(nc1)CC(=O)CF 1458a_100025705728_100015361967 [0,1,0,0,0,1|1,0,0]=3 4220 B12R1.49 Cc1ccc(nc1)CC(=O)CO 1458a_100000210174_100000691093 [0,1,0,0,0,1|1,0,0]=3 4221 B12R1.49 Cc1cnc(cn1)CC(=O)CO 1458a_100000210174_100000752025 [0,1,0,0,0,1|2,0,0]=4 4222 B12R1.49 Cc1cnc(nc1)CC(=O)CO 1458a_100000210174_100000685645 [0,1,0,0,0,1|2,0,0]=4 4223 B12R1.49 O=C(CF)Cc1ccc(cc1)Br 1458a_100000198978_100015361967 [0,1,0,0,0,1|1,0,0]=3 4224 B12R1.49 O=C(CF)Cc1ccc(cc1)Cl 1458a_100000211027_100015361967 [0,1,0,0,0,1|1,0,0]=3 4225 B12R1.49 O=C(CF)Cc1ccc(cc1)F 1458a_100000210951_100015361967 [0,1,0,0,0,1|1,0,0]=3 4226 B12R1.49 O=C(CF)Cc1ccc(cc1)I 1458a_100000688869_100015361967 [0,1,0,0,0,1|1,0,0]=3 4227 B12R1.49 O=C(CF)Cc1ccc(cc1)O 1458a_100000198540_100015361967 [0,1,0,0,0,1|1,0,0]=3 4228 B12R1.49 O=C(CF)Cc1ccc(cn1)Br 1458a_100020629044_100015361967 [0,1,0,0,0,1|2,0,0]=4 4229 B12R1.49 O=C(CF)Cc1ccc(cn1)Cl 1458a_100000728320_100015361967 [0,1,0,0,0,1|2,0,0]=4 4230 B12R1.49 O=C(CF)Cc1ccc(nc1)Br 1458a_100010067268_100015361967 [0,1,0,0,0,1|2,0,0]=4 4231 B12R1.49 O=C(CF)Cc1ccc(nc1)Cl 1458a_100000061944_100015361967 [0,1,0,0,0,1|2,0,0]=4 4232 B12R1.49 O=C(CF)Cn1ccc(=O)cc1 1458a_200000238563_100015361967 [0,1,0,0,0,1|2,0,0]=4 4233 B12R1.49 O=C(CO)Cc1ccc(cc1)Br 1458a_100000210174_100000189115 [0,1,0,0,0,1|1,0,0]=3 4234 B12R1.49 O=C(CO)Cc1ccc(cc1)Cl 1458a_100000210174_100000694040 [0,1,0,0,0,1|1,0,0]=3 4235 B12R1.49 O=C(CO)Cc1ccc(cc1)F 1458a_100000210174_100000198546 [0,1,0,0,0,1|1,0,0]=3 4236 B12R1.49 O=C(CO)Cc1ccc(cc1)I 1458a_100000210174_100000189116 [0,1,0,0,0,1|1,0,0]=3 4237 B12R1.49 O=C(CO)Cc1ccc(cn1)Br 1458a_100000210174_100000702658 [0,1,0,0,0,1|2,0,0]=4 4238 B12R1.49 O=C(CO)Cc1ccc(cn1)Cl 1458a_100000210174_100012066911 [0,1,0,0,0,1|2,0,0]=4 4239 B12R1.49 O=C(CO)Cc1ccc(cn1)F 1458a_100000210174_100000703193 [0,1,0,0,0,1|2,0,0]=4 4240 B12R1.49 O=C(CO)Cc1ccc(nc1)Br 1458a_100000210174_100009831999 [0,1,0,0,0,1|2,0,0]=4 4241 B12R1.49 O=C(CO)Cc1ccc(nc1)Cl 1458a_100000210174_100000735431 [0,1,0,0,0,1|2,0,0]=4 4242 B12R1.49 O=C(CO)Cc1ccc(nc1)F 1458a_100000210174_100009820150 [0,1,0,0,0,1|2,0,0]=4 4243 B12R1.49 O=C(CO)Nc1ccc(cc1)Br 22a_100000210018_100000210174 [0,1,0,0,0,1|1,0,0]=3 4244 B12R1.49 O=C(CO)Nc1ccc(cc1)Br 527a_100000210018_100000210174 [0,1,0,0,0,1|1,0,0]=3 4245 B12R1.49 O=C(CO)Nc1ccc(cc1)Cl 22a_100000210052_100000210174 [0,1,0,0,0,1|1,0,0]=3 4246 B12R1.49 O=C(CO)Nc1ccc(cc1)Cl 527a_100000210052_100000210174 [0,1,0,0,0,1|1,0,0]=3 4247 B12R1.49 O=C(CO)Nc1ccc(cc1)F 22a_100000185862_100000210174 [0,1,0,0,0,1|1,0,0]=3 4248 B12R1.49 O=C(CO)Nc1ccc(cc1)F 527a_100000185862_100000210174 [0,1,0,0,0,1|1,0,0]=3 4249 B12R1.49 O=C(CO)Nc1ccc(cc1)I 22a_100000185761_100000210174 [0,1,0,0,0,1|1,0,0]=3 4250 B12R1.49 O=C(CO)Nc1ccc(cc1)I 527a_100000185761_100000210174 [0,1,0,0,0,1|1,0,0]=3 4251 B12R1.49 O=C(CO)Nc1ccc(cc1)O 22a_100000185829_100000210174 [0,1,0,0,0,1|1,0,0]=3 4252 B12R1.106 CS(=O)(=O)Cc1ccc(cc1)O 271570a_203496583355_100009814647 [0,1,0,0,0,1|2,0,0]=4 4253 B12R1.106 CS(=O)(=O)Nc1ccc(cc1)Cl 40a_100000210052_100000738038 [0,1,0,0,0,1|2,0,0]=4 4254 B12R1.106 CS(=O)(=O)Nc1ccc(cc1)F 40a_100000185862_100000738038 [0,1,0,0,0,1|2,0,0]=4 4255 B12R1.106 CS(=O)(=O)Nc1ccc(cc1)I 40a_100000185761_100000738038 [0,1,0,0,0,1|2,0,0]=4 4256 B12R1.106 CS(=O)(=O)Nc1ccc(cc1)O 271570a_203496583355_200000165602 [0,1,0,0,0,1|2,0,0]=4 4257 B12R1.106 Cc1ccc(cc1)NC(C)(C)C 34a_100000124888_100000210625 [0,1,0,0,0,1|1,0,1]=4 4258 B12R1.106 Cc1ccc(cc1)NS(=O)(=O)C 40a_100000124888_100000738038 [0,1,0,0,0,1|1,0,0]=3 4259 B12R1.106 Cc1ccc(cc1)OC(C)(C)C 34a_100000210336_100000210625 [0,1,0,0,0,1|1,0,1]=4 4260 B12R1.106 Cc1ccc(cc1)SC(C)(C)C 62a_100000186775_100000211941 [0,1,0,0,0,1|1,0,1]=4 4261 B12R1.106 Cc1ccc(cc1)SC(C)(C)C 62a_100000211941_100000186775 [0,1,0,0,0,1|1,0,1]=4 4262 B12R1.233 CC(=Cc1ccc(c[n+]1[O-])C)C 271570a_100102525489_100009819918 [0,1,0,0,0,1|2,0,0]=4 4263 B12R1.233 CC(=Cc1ccc(cc1Br)Br)C 271570a_100102525489_100011484698 [0,1,0,0,0,1|2,0,0]=4 4264 B12R1.233 CC(=Cc1ccc(cc1Br)C)C 271570a_100102525489_100009813563 [0,1,0,0,0,1|1,0,0]=3 4265 B12R1.233 CC(=Cc1ccc(cc1Br)Cl)C 271570a_100102525489_100011219703 [0,1,0,0,0,1|2,0,0]=4 4266 B12R1.233 CC(=Cc1ccc(cc1Br)F)C 271570a_100102525489_100011217111 [0,1,0,0,0,1|2,0,0]=4 4267 B12R1.233 CC(=Cc1ccc(cc1Br)N)C 271570a_100102525489_100000750458 [0,1,0,0,0,1|2,0,0]=4 4268 B12R1.233 CC(=Cc1ccc(cc1Br)O)C 271570a_100102525489_100000701344 [0,1,0,0,0,1|2,0,0]=4 4269 B12R1.233 CC(=Cc1ccc(cc1C)Br)C 271570a_100102525489_100000701812 [0,1,0,0,0,1|2,0,0]=4 4270 B12R1.233 CC(=Cc1ccc(cc1C)C)C 271570a_100102525489_100011217332 [0,1,0,0,0,1|1,0,0]=3 4271 B12R1.233 CC(=Cc1ccc(cc1C)Cl)C 271570a_100102525489_100011219607 [0,1,0,0,0,1|2,0,0]=4 4272 B12R1.233 CC(=Cc1ccc(cc1C)F)C 271570a_100102525489_100011205405 [0,1,0,0,0,1|2,0,0]=4 4273 B12R1.233 CC(=Cc1ccc(cc1C)N)C 271570a_100102525489_100000210723 [0,1,0,0,0,1|2,0,0]=4 4274 B12R1.233 CC(=Cc1ccc(cc1C)O)C 271570a_100102525489_100000729255 [0,1,0,0,0,1|2,0,0]=4 4275 B12R1.233 CC(=Cc1ccc(cc1Cl)Br)C 271570a_100102525489_100011216062 [0,1,0,0,0,1|2,0,0]=4 4276 B12R1.233 CC(=Cc1ccc(cc1Cl)C)C 271570a_100102525489_100011263221 [0,1,0,0,0,1|1,0,0]=3 4277 B12R1.233 CC(=Cc1ccc(cc1Cl)Cl)C 271570a_100102525489_100000699841 [0,1,0,0,0,1|2,0,0]=4 4278 B12R1.233 CC(=Cc1ccc(cc1Cl)F)C 271570a_100102525489_100000733362 [0,1,0,0,0,1|2,0,0]=4 4279 B12R1.233 CC(=Cc1ccc(cc1Cl)N)C 271570a_100102525489_100000761885 [0,1,0,0,0,1|2,0,0]=4 4280 B12R1.233 CC(=Cc1ccc(cc1Cl)O)C 271570a_100102525489_100000047559 [0,1,0,0,0,1|2,0,0]=4 4281 B12R1.233 CC(=Cc1ccc(cc1F)Br)C 271570a_100102525489_100009814013 [0,1,0,0,0,1|2,0,0]=4 4282 B12R1.233 CC(=Cc1ccc(cc1F)C)C 271570a_100102525489_100011216119 [0,1,0,0,0,1|1,0,0]=3 4283 B12R1.233 CC(=Cc1ccc(cc1F)Cl)C 271570a_100102525489_100011216042 [0,1,0,0,0,1|2,0,0]=4 4284 B12R1.233 CC(=Cc1ccc(cc1F)F)C 271570a_100102525489_100000750030 [0,1,0,0,0,1|2,0,0]=4 4285 B12R1.233 CC(=Cc1ccc(cc1F)N)C 271570a_100102525489_100011356925 [0,1,0,0,0,1|2,0,0]=4 4286 B12R1.233 CC(=Cc1ccc(cc1F)O)C 271570a_100102525489_100000755031 [0,1,0,0,0,1|2,0,0]=4 4287 B12R1.233 CC(=Cc1ccc(cc1N)Br)C 271570a_100102525489_100000743836 [0,1,0,0,0,1|2,0,0]=4 4288 B12R1.233 CC(=Cc1ccc(cc1N)C)C 271570a_100102525489_100011216686 [0,1,0,0,0,1|1,0,0]=3 4289 B12R1.233 CC(=Cc1ccc(cc1N)Cl)C 271570a_100102525489_100000761886 [0,1,0,0,0,1|2,0,0]=4 4290 B12R1.233 CC(=Cc1ccc(cc1N)F)C 271570a_100102525489_100011218093 [0,1,0,0,0,1|2,0,0]=4 4291 B12R1.233 CC(=Cc1ccc(cc1N)N)C 271570a_100102525489_200012175722 [0,1,0,0,0,1|2,0,0]=4 4292 B12R1.233 CC(=Cc1ccc(cc1N)O)C 271570a_100102525489_100011999798 [0,1,0,0,0,1|2,0,0]=4 4293 B12R1.233 CC(=Cc1ccc(cc1O)Br)C 271570a_100102525489_100012344904 [0,1,0,0,0,1|2,0,0]=4 4294 B12R1.233 CC(=Cc1ccc(cc1O)C)C 271570a_100102525489_100012002257 [0,1,0,0,0,1|1,0,0]=3 4295 B12R1.233 CC(=Cc1ccc(cc1O)Cl)C 271570a_100102525489_100000050036 [0,1,0,0,0,1|2,0,0]=4 4296 B12R1.233 CC(=Cc1ccc(cc1O)F)C 271570a_100102525489_100000690578 [0,1,0,0,0,1|2,0,0]=4 4297 B12R1.233 CC(=Cc1ccc(cc1O)O)C 271570a_100102525489_100009813921 [0,1,0,0,0,1|2,0,0]=4 4298 B12R1.233 CC(=Cc1ccc(nc1C)C)C 271570a_100102525489_100009813853 [0,1,0,0,0,1|2,0,0]=4 4299 B12R1.233 CC(=Cc1ccc(nc1F)C)C 271570a_100102525489_100010006597 [0,1,0,0,0,1|2,0,0]=4 4300 B12R1.233 CC(=Cc1ccc(nc1N)C)C 271570a_100102525489_100009816662 [0,1,0,0,0,1|2,0,0]=4 4301 B12R1.233 CC(=Cc1ccc(nc1O)C)C 271570a_100102525489_100009817604 [0,1,0,0,0,1|2,0,0]=4 4302 B12R1.233 CC(=Cc1cnc(cc1C)C)C 271570a_100102525489_100009819613 [0,1,0,0,0,1|2,0,0]=4 4303 B12R1.233 CC(=Cc1cnc(cc1N)C)C 271570a_100102525489_100009817891 [0,1,0,0,0,1|2,0,0]=4 4304 B12R1.233 CC(=Cc1cnc(cc1O)C)C 271570a_100102525489_100011016184 [0,1,0,0,0,1|2,0,0]=4 4305 B12R1.233 CC(=Cc1ncc(cc1C)C)C 271570a_100102525489_100009864548 [0,1,0,0,0,1|2,0,0]=4 4306 B12R1.233 CC(=Cc1ncc(cc1F)C)C 271570a_100102525489_100009819633 [0,1,0,0,0,1|2,0,0]=4 4307 B12R1.233 CC(=Cc1ncc(cc1N)C)C 271570a_100102525489_100000733613 [0,1,0,0,0,1|2,0,0]=4 4308 B12R1.233 CC(=Cc1ncc(cc1O)C)C 271570a_100102525489_100012000487 [0,1,0,0,0,1|2,0,0]=4 4309 B12R1.233 CC(=O)Cc1ccc(cc1Br)Br 1458a_100000070787_200012351560 [0,1,0,0,0,1|1,0,0]=3 4310 B12R1.233 CC(=O)Cc1ccc(cc1Br)Br 1458a_100010172832_200000210301 [0,1,0,0,0,1|1,0,0]=3 4311 B12R1.233 CC(=O)Cc1ccc(cc1Br)Cl 1458a_100000070787_100000755608 [0,1,0,0,0,1|1,0,0]=3 4312 B12R1.233 CC(=O)Cc1ccc(cc1Br)Cl 1458a_100000755479_200000210301 [0,1,0,0,0,1|1,0,0]=3 4313 B12R1.233 CC(=O)Cc1ccc(cc1Br)F 1458a_100000070787_100000243222 [0,1,0,0,0,1|1,0,0]=3 4314 B12R1.233 CC(=O)Cc1ccc(cc1Br)F 1458a_100000708238_200000210301 [0,1,0,0,0,1|1,0,0]=3 4315 B12R1.233 CC(=O)Cc1ccc(cc1Br)I 1458a_100000070787_100010146610 [0,1,0,0,0,1|1,0,0]=3 4316 B12R1.233 CC(=O)Cc1ccc(cc1Br)O 1458a_100010176083_200000210301 [0,1,0,0,0,1|1,0,0]=3 4317 B12R1.233 CC(=O)Cc1ccc(cc1C)Br 1458a_100000070787_100000708836 [0,1,0,0,0,1|1,0,0]=3 4318 B12R1.233 CC(=O)Cc1ccc(cc1C)Br 1458a_100000697930_200000210301 [0,1,0,0,0,1|1,0,0]=3 4319 B12R1.233 CC(=O)Cc1ccc(cc1C)C 1458a_100000070787_100011219618 [0,1,0,0,0,1|0,0,0]=2 4320 B12R1.233 CC(=O)Cc1ccc(cc1C)C 1458a_100011236500_200000210301 [0,1,0,0,0,1|0,0,0]=2 4321 B12R1.233 CC(=O)Cc1ccc(cc1C)Cl 1458a_100000070787_100012361307 [0,1,0,0,0,1|1,0,0]=3 4322 B12R1.233 CC(=O)Cc1ccc(cc1C)F 1458a_100000070787_100000700533 [0,1,0,0,0,1|1,0,0]=3 4323 B12R1.233 CC(=O)Cc1ccc(cc1C)F 1458a_100011667441_200000210301 [0,1,0,0,0,1|1,0,0]=3 4324 B12R1.233 CC(=O)Cc1ccc(cc1Cl)Br 1458a_100000070787_100011740631 [0,1,0,0,0,1|1,0,0]=3 4325 B12R1.233 CC(=O)Cc1ccc(cc1Cl)Br 1458a_100012361378_200000210301 [0,1,0,0,0,1|1,0,0]=3 4326 B12R1.233 CC(=O)Cc1ccc(cc1Cl)C 1458a_100000070787_100012349684 [0,1,0,0,0,1|0,0,0]=2 4327 B12R1.233 CC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000070787_100000188473 [0,1,0,0,0,1|1,0,0]=3 4328 B12R1.233 CC(=O)Cc1ccc(cc1Cl)Cl 1458a_100000210926_200000210301 [0,1,0,0,0,1|1,0,0]=3 4329 B12R1.233 CC(=O)Cc1ccc(cc1Cl)F 1458a_100000070787_100011216360 [0,1,0,0,0,1|1,0,0]=3 4330 B12R1.233 CC(=O)Cc1ccc(cc1Cl)F 1458a_100000690284_200000210301 [0,1,0,0,0,1|1,0,0]=3 4331 B12R1.233 CC(=O)Cc1ccc(cc1F)Br 1458a_100000070787_100000211606 [0,1,0,0,0,1|1,0,0]=3 4332 B12R1.233 CC(=O)Cc1ccc(cc1F)Br 1458a_100011295475_200000210301 [0,1,0,0,0,1|1,0,0]=3 4333 B12R1.233 CC(=O)Cc1ccc(cc1F)C 1458a_100000042674_200000210301 [0,1,0,0,0,1|0,0,0]=2 4334 B12R1.233 CC(=O)Cc1ccc(cc1F)C 1458a_100000070787_100012002367 [0,1,0,0,0,1|0,0,0]=2 4335 B12R1.233 CC(=O)Cc1ccc(cc1F)Cl 1458a_100000070787_100000709361 [0,1,0,0,0,1|1,0,0]=3 4336 B12R1.233 CC(=O)Cc1ccc(cc1F)Cl 1458a_100011830378_200000210301 [0,1,0,0,0,1|1,0,0]=3 4337 B12R1.233 CC(=O)Cc1ccc(cc1F)F 1458a_100000070787_100000748237 [0,1,0,0,0,1|1,0,0]=3 4338 B12R1.233 CC(=O)Cc1ccc(cc1F)F 1458a_100000684719_200000210301 [0,1,0,0,0,1|1,0,0]=3 4339 B12R1.233 CC(=O)Cc1ccc(cc1F)I 1458a_100000070787_100010244991 [0,1,0,0,0,1|1,0,0]=3 4340 B12R1.233 CC(=O)Cc1ccc(cc1F)I 1458a_100010149628_200000210301 [0,1,0,0,0,1|1,0,0]=3 4341 B12R1.233 CC(=O)Cc1ccc(cc1F)O 1458a_100000090534_200000210301 [0,1,0,0,0,1|1,0,0]=3 4342 B12R1.233 CC(=O)Cc1ccc(cc1I)Br 1458a_100000070787_100010146615 [0,1,0,0,0,1|1,0,0]=3 4343 B12R1.233 CC(=O)Cc1ccc(cc1I)Cl 1458a_100000070787_100010254388 [0,1,0,0,0,1|1,0,0]=3 4344 B12R1.233 CC(=O)Cc1ccc(cc1I)F 1458a_100000070787_100012354799 [0,1,0,0,0,1|1,0,0]=3 4345 B12R1.233 CC(=O)Cc1ccc(cc1O)Br 1458a_100000707504_200000210301 [0,1,0,0,0,1|1,0,0]=3 4346 B12R1.233 CC(=O)Cc1ccc(nc1Br)C 1458a_100000070787_200010064658 [0,1,0,0,0,1|1,0,0]=3 4347 B12R1.233 CC(=O)Cc1ccc(nc1Cl)Cl 1458a_100000070787_100000722033 [0,1,0,0,0,1|2,0,0]=4 4348 B12R1.233 CC(=O)Cc1ccc(nc1Cl)Cl 1458a_200010067290_200000210301 [0,1,0,0,0,1|2,0,0]=4 4349 B12R1.233 CC(=O)Cc1cnc(cc1C)F 1458a_100000070787_100010382440 [0,1,0,0,0,1|2,0,0]=4 4350 B12R1.233 CC(=O)Cc1cnc(cc1Cl)Cl 1458a_100000070787_100011997056 [0,1,0,0,0,1|2,0,0]=4 4351 B12R1.233 CC(=O)Cc1ncc(cc1Br)Cl 1458a_200012351915_200000210301 [0,1,0,0,0,1|2,0,0]=4 4352 B12R1.233 CC(=O)Cc1ncc(cc1C)C 1458a_100000070787_100016990036 [0,1,0,0,0,1|1,0,0]=3 4353 B12R1.233 CC(=O)Cc1ncc(cc1F)Br 1458a_100012351917_200000210301 [0,1,0,0,0,1|2,0,0]=4 4354 B12R1.233 CC(=O)Cc1ncc(cc1F)Cl 1458a_100000070787_200009879301 [0,1,0,0,0,1|2,0,0]=4 4355 B12R1.233 CC(=O)Cn1ccc(cc1=O)C 1458a_100000721392_200000210301 [0,1,0,0,0,1|1,0,0]=3 4356 B12R1.233 CC(=O)Nc1ccc(cc1Br)Br 11a_100000211012_100015343762 [0,1,0,0,0,1|1,0,0]=3 4357 B12R1.233 CC(=O)Nc1ccc(cc1Br)Br 1626a_100000211012_100015343762 [0,1,0,0,0,1|1,0,0]=3 4358 B12R1.233 CC(=O)Nc1ccc(cc1Br)C 11a_100000210942_100015343762 [0,1,0,0,0,1|0,0,0]=2 4359 B12R1.233 CC(=O)Nc1ccc(cc1Br)C 1626a_100000210942_100015343762 [0,1,0,0,0,1|0,0,0]=2 4360 B12R1.233 CC(=O)Nc1ccc(cc1Br)Cl 11a_100000752454_100015343762 [0,1,0,0,0,1|1,0,0]=3 4361 B12R1.233 CC(=O)Nc1ccc(cc1Br)Cl 1626a_100000752454_100015343762 [0,1,0,0,0,1|1,0,0]=3 4362 B12R1.233 CC(=O)Nc1ccc(cc1Br)F 11a_100000738039_100015343762 [0,1,0,0,0,1|1,0,0]=3 4363 B12R1.233 CC(=O)Nc1ccc(cc1Br)F 1626a_100000738039_100015343762 [0,1,0,0,0,1|1,0,0]=3 4364 B12R1.233 CC(=O)Nc1ccc(cc1Br)I 11a_100000750455_100015343762 [0,1,0,0,0,1|1,0,0]=3 4365 B12R1.233 CC(=O)Nc1ccc(cc1Br)I 1626a_100000750455_100015343762 [0,1,0,0,0,1|1,0,0]=3 4366 B12R1.233 CC(=O)Nc1ccc(cc1Br)O 22a_100012001276_100000070787 [0,1,0,0,0,1|1,0,0]=3 4367 B12R1.233 CC(=O)Nc1ccc(cc1Br)O 527a_100012001276_100103153847 [0,1,0,0,0,1|1,0,0]=3 4368 B12R1.233 CC(=O)Nc1ccc(cc1C)Br 11a_100000211769_100015343762 [0,1,0,0,0,1|1,0,0]=3 4369 B12R1.233 CC(=O)Nc1ccc(cc1C)Br 1626a_100000211769_100015343762 [0,1,0,0,0,1|1,0,0]=3 4370 B12R1.233 CC(=O)Nc1ccc(cc1C)Br 22a_100000211769_100000070787 [0,1,0,0,0,1|1,0,0]=3 4371 B12R1.233 CC(=O)Nc1ccc(cc1C)C 11a_100000736561_100015343762 [0,1,0,0,0,1|0,0,0]=2 4372 B12R1.233 CC(=O)Nc1ccc(cc1C)C 1626a_100000736561_100015343762 [0,1,0,0,0,1|0,0,0]=2 4373 B12R1.233 CC(=O)Nc1ccc(cc1C)C 22a_100000736561_100000070787 [0,1,0,0,0,1|0,0,0]=2 4374 B12R1.233 CC(=O)Nc1ccc(cc1C)C 527a_100000736561_100103153847 [0,1,0,0,0,1|0,0,0]=2 4375 B12R1.233 CC(=O)Nc1ccc(cc1C)Cl 11a_100000210418_100015343762 [0,1,0,0,0,1|1,0,0]=3 4376 B12R1.233 CC(=O)Nc1ccc(cc1C)Cl 1626a_100000210418_100015343762 [0,1,0,0,0,1|1,0,0]=3 4377 B12R1.233 CC(=O)Nc1ccc(cc1C)Cl 22a_100000210418_100000070787 [0,1,0,0,0,1|1,0,0]=3 4378 B12R1.233 CC(=O)Nc1ccc(cc1C)F 11a_100000211637_100015343762 [0,1,0,0,0,1|1,0,0]=3 4379 B12R1.233 CC(=O)Nc1ccc(cc1C)F 1626a_100000211637_100015343762 [0,1,0,0,0,1|1,0,0]=3 4380 B12R1.233 CC(=O)Nc1ccc(cc1C)F 22a_100000211637_100000070787 [0,1,0,0,0,1|1,0,0]=3 4381 B12R1.233 CC(=O)Nc1ccc(cc1C)F 527a_100000211637_100103153847 [0,1,0,0,0,1|1,0,0]=3 4382 B12R1.233 CC(=O)Nc1ccc(cc1C)I 11a_100000184554_100015343762 [0,1,0,0,0,1|1,0,0]=3 4383 B12R1.233 CC(=O)Nc1ccc(cc1C)I 1626a_100000184554_100015343762 [0,1,0,0,0,1|1,0,0]=3 4384 B12R1.233 CC(=O)Nc1ccc(cc1C)I 22a_100000184554_100000070787 [0,1,0,0,0,1|1,0,0]=3 4385 B12R1.233 CC(=O)Nc1ccc(cc1C)O 22a_100000756630_100000070787 [0,1,0,0,0,1|1,0,0]=3 4386 B12R1.233 CC(=O)Nc1ccc(cc1C)O 271570a_203496583355_100000152120 [0,1,0,0,0,1|1,0,0]=3 4387 B12R1.233 CC(=O)Nc1ccc(cc1C)O 527a_100000756630_100103153847 [0,1,0,0,0,1|1,0,0]=3 4388 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Br 11a_100000211467_100015343762 [0,1,0,0,0,1|1,0,0]=3 4389 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Br 1626a_100000211467_100015343762 [0,1,0,0,0,1|1,0,0]=3 4390 B12R1.233 CC(=O)Nc1ccc(cc1Cl)C 11a_100000210522_100015343762 [0,1,0,0,0,1|0,0,0]=2 4391 B12R1.233 CC(=O)Nc1ccc(cc1Cl)C 1626a_100000210522_100015343762 [0,1,0,0,0,1|0,0,0]=2 4392 B12R1.233 CC(=O)Nc1ccc(cc1Cl)C 22a_100000210522_100000070787 [0,1,0,0,0,1|0,0,0]=2 4393 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Cl 11a_100000185861_100015343762 [0,1,0,0,0,1|1,0,0]=3 4394 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Cl 1626a_100000185861_100015343762 [0,1,0,0,0,1|1,0,0]=3 4395 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Cl 22a_100000185861_100000070787 [0,1,0,0,0,1|1,0,0]=3 4396 B12R1.233 CC(=O)Nc1ccc(cc1Cl)F 11a_100000212003_100015343762 [0,1,0,0,0,1|1,0,0]=3 4397 B12R1.233 CC(=O)Nc1ccc(cc1Cl)F 1626a_100000212003_100015343762 [0,1,0,0,0,1|1,0,0]=3 4398 B12R1.233 CC(=O)Nc1ccc(cc1Cl)F 22a_100000212003_100000070787 [0,1,0,0,0,1|1,0,0]=3 4399 B12R1.233 CC(=O)Nc1ccc(cc1Cl)I 11a_100011218065_100015343762 [0,1,0,0,0,1|1,0,0]=3 4400 B12R1.233 CC(=O)Nc1ccc(cc1Cl)I 1626a_100011218065_100015343762 [0,1,0,0,0,1|1,0,0]=3 4401 B12R1.233 CC(=O)Nc1ccc(cc1Cl)I 22a_100011218065_100000070787 [0,1,0,0,0,1|1,0,0]=3 4402 B12R1.233 CC(=O)Nc1ccc(cc1Cl)O 22a_100011215599_100000070787 [0,1,0,0,0,1|1,0,0]=3 4403 B12R1.233 CC(=O)Nc1ccc(cc1Cl)O 271570a_203496583355_100011273303 [0,1,0,0,0,1|1,0,0]=3 4404 B12R1.233 CC(=O)Nc1ccc(cc1Cl)O 527a_100011215599_100103153847 [0,1,0,0,0,1|1,0,0]=3 4405 B12R1.233 CC(=O)Nc1ccc(cc1F)Br 11a_100000210722_100015343762 [0,1,0,0,0,1|1,0,0]=3 4406 B12R1.233 CC(=O)Nc1ccc(cc1F)Br 1626a_100000210722_100015343762 [0,1,0,0,0,1|1,0,0]=3 4407 B12R1.233 CC(=O)Nc1ccc(cc1F)Br 22a_100000210722_100000070787 [0,1,0,0,0,1|1,0,0]=3 4408 B12R1.233 CC(=O)Nc1ccc(cc1F)C 11a_100000211023_100015343762 [0,1,0,0,0,1|0,0,0]=2 4409 B12R1.233 CC(=O)Nc1ccc(cc1F)C 1626a_100000211023_100015343762 [0,1,0,0,0,1|0,0,0]=2 4410 B12R1.233 CC(=O)Nc1ccc(cc1F)C 22a_100000211023_100000070787 [0,1,0,0,0,1|0,0,0]=2 4411 B12R1.233 CC(=O)Nc1ccc(cc1F)C 527a_100000211023_100103153847 [0,1,0,0,0,1|0,0,0]=2 4412 B12R1.233 CC(=O)Nc1ccc(cc1F)Cl 11a_100000211020_100015343762 [0,1,0,0,0,1|1,0,0]=3 4413 B12R1.233 CC(=O)Nc1ccc(cc1F)Cl 1626a_100000211020_100015343762 [0,1,0,0,0,1|1,0,0]=3 4414 B12R1.233 CC(=O)Nc1ccc(cc1F)Cl 22a_100000211020_100000070787 [0,1,0,0,0,1|1,0,0]=3 4415 B12R1.233 CC(=O)Nc1ccc(cc1F)F 11a_100000210720_100015343762 [0,1,0,0,0,1|1,0,0]=3 4416 B12R1.233 CC(=O)Nc1ccc(cc1F)F 1626a_100000210720_100015343762 [0,1,0,0,0,1|1,0,0]=3 4417 B12R1.233 CC(=O)Nc1ccc(cc1F)F 22a_100000210720_100000070787 [0,1,0,0,0,1|1,0,0]=3 4418 B12R1.233 CC(=O)Nc1ccc(cc1F)I 11a_100011215594_100015343762 [0,1,0,0,0,1|1,0,0]=3 4419 B12R1.233 CC(=O)Nc1ccc(cc1F)I 1626a_100011215594_100015343762 [0,1,0,0,0,1|1,0,0]=3 4420 B12R1.233 CC(=O)Nc1ccc(cc1F)I 22a_100011215594_100000070787 [0,1,0,0,0,1|1,0,0]=3 4421 B12R1.233 CC(=O)Nc1ccc(cc1F)O 22a_100000759473_100000070787 [0,1,0,0,0,1|1,0,0]=3 4422 B12R1.233 CC(=O)Nc1ccc(cc1F)O 271570a_203496583355_100000155584 [0,1,0,0,0,1|1,0,0]=3 4423 B12R1.233 CC(=O)Nc1ccc(cc1F)O 527a_100000759473_100103153847 [0,1,0,0,0,1|1,0,0]=3 4424 B12R1.233 CC(=O)Nc1ccc(cc1I)Br 11a_100000187925_100015343762 [0,1,0,0,0,1|1,0,0]=3 4425 B12R1.233 CC(=O)Nc1ccc(cc1I)Br 1626a_100000187925_100015343762 [0,1,0,0,0,1|1,0,0]=3 4426 B12R1.233 CC(=O)Nc1ccc(cc1I)C 11a_100011356834_100015343762 [0,1,0,0,0,1|0,0,0]=2 4427 B12R1.233 CC(=O)Nc1ccc(cc1I)C 1626a_100011356834_100015343762 [0,1,0,0,0,1|0,0,0]=2 4428 B12R1.233 CC(=O)Nc1ccc(cc1I)Cl 11a_100000761889_100015343762 [0,1,0,0,0,1|1,0,0]=3 4429 B12R1.233 CC(=O)Nc1ccc(cc1I)Cl 1626a_100000761889_100015343762 [0,1,0,0,0,1|1,0,0]=3 4430 B12R1.233 CC(=O)Nc1ccc(cc1I)F 11a_100000760547_100015343762 [0,1,0,0,0,1|1,0,0]=3 4431 B12R1.233 CC(=O)Nc1ccc(cc1I)F 1626a_100000760547_100015343762 [0,1,0,0,0,1|1,0,0]=3 4432 B12R1.233 CC(=O)Nc1ccc(cc1I)F 22a_100000760547_100000070787 [0,1,0,0,0,1|1,0,0]=3 4433 B12R1.233 CC(=O)Nc1ccc(cc1I)I 11a_100010002754_100015343762 [0,1,0,0,0,1|1,0,0]=3 4434 B12R1.233 CC(=O)Nc1ccc(cc1I)I 1626a_100010002754_100015343762 [0,1,0,0,0,1|1,0,0]=3 4435 B12R1.233 CC(=O)Nc1ccc(cc1I)O 22a_100010084370_100000070787 [0,1,0,0,0,1|1,0,0]=3 4436 B12R1.233 CC(=O)Nc1ccc(cc1I)O 527a_100010084370_100103153847 [0,1,0,0,0,1|1,0,0]=3 4437 B12R1.233 CC(=O)Nc1ccc(cc1N)O 271570a_203496583355_100000749274 [0,1,0,0,0,1|1,0,0]=3 4438 B12R1.233 CC(=O)Nc1ccc(cc1O)Br 22a_100000739049_100000070787 [0,1,0,0,0,1|1,0,0]=3 4439 B12R1.233 CC(=O)Nc1ccc(cc1O)Br 271570a_203496583355_100009813020 [0,1,0,0,0,1|1,0,0]=3 4440 B12R1.233 CC(=O)Nc1ccc(cc1O)Br 527a_100000739049_100103153847 [0,1,0,0,0,1|1,0,0]=3 4441 B12R1.233 CC(=O)Nc1ccc(cc1O)C 22a_100000211527_100000070787 [0,1,0,0,0,1|0,0,0]=2 4442 B12R1.233 CC(=O)Nc1ccc(cc1O)C 271570a_203496583355_100000152032 [0,1,0,0,0,1|0,0,0]=2 4443 B12R1.233 CC(=O)Nc1ccc(cc1O)C 527a_100000211527_100103153847 [0,1,0,0,0,1|0,0,0]=2 4444 B12R1.233 CC(=O)Nc1ccc(cc1O)Cl 22a_100000185728_100000070787 [0,1,0,0,0,1|1,0,0]=3 4445 B12R1.233 CC(=O)Nc1ccc(cc1O)Cl 527a_100000185728_100103153847 [0,1,0,0,0,1|1,0,0]=3 4446 B12R1.233 CC(=O)Nc1ccc(cc1O)F 22a_100000753323_100000070787 [0,1,0,0,0,1|1,0,0]=3 4447 B12R1.233 CC(=O)Nc1ccc(cc1O)F 271570a_203496583355_100011215554 [0,1,0,0,0,1|1,0,0]=3 4448 B12R1.233 CC(=O)Nc1ccc(cc1O)F 527a_100000753323_100103153847 [0,1,0,0,0,1|1,0,0]=3 4449 B12R1.233 CC(=O)Nc1ccc(cc1O)I 22a_100000057187_100000070787 [0,1,0,0,0,1|1,0,0]=3 4450 B12R1.233 CC(=O)Nc1ccc(cc1O)I 527a_100000057187_100103153847 [0,1,0,0,0,1|1,0,0]=3 4451 B12R1.233 CC(=O)Nc1ccc(cc1O)O 22a_100000106777_100000070787 [0,1,0,0,0,1|1,0,0]=3 4452 B12R1.233 CC(=O)Nc1ccc(cc1O)O 527a_100000106777_100103153847 [0,1,0,0,0,1|1,0,0]=3 4453 B12R1.233 CC(=O)Nc1ncc(cc1C)O 271570a_203496583355_200011934169 [0,1,0,0,0,1|2,0,0]=4 4454 B12R1.233 CC(=O)Nc1ncc(cc1O)C 271570a_203496583355_200009816786 [0,1,0,0,0,1|1,0,0]=3 4455 B12R1.233 CC(=O)Oc1ccc(cc1F)O 271570a_203496583355_100009811628 [0,1,0,0,0,1|1,0,0]=3 4456 B12R1.233 Cc1cc(ccc1CC(=O)[13CH3])Br 1458a_100000697930_200025704644 [0,1,0,0,0,1|1,0,0]=3 4457 B12R1.233 Cc1cc(ccc1CC(=O)[13CH3])F 1458a_100011667441_200025704644 [0,1,0,0,0,1|1,0,0]=3 4458 B12R1.233 Cc1ccc(c(c1)Br)CN(C)C 270004a_100102631434_100000692596 [0,1,0,0,0,1|2,0,0]=4 4459 B12R1.233 Cc1ccc(c(c1)Br)NC(C)C 34a_100000210942_100000210206 [0,1,0,0,0,1|1,0,1]=4 4460 B12R1.233 Cc1ccc(c(c1)Br)OC(C)C 34a_100000210800_100000210206 [0,1,0,0,0,1|1,0,1]=4 4461 B12R1.233 Cc1ccc(c(c1)Br)OC(C)C 7a_100000210800_100000210206 [0,1,0,0,0,1|1,0,1]=4 4462 B12R1.233 Cc1ccc(c(c1)Br)SC(C)C 62a_100000210206_100009813563 [0,1,0,0,0,1|1,0,1]=4 4463 B12R1.233 Cc1ccc(c(c1)Br)SC(C)C 62a_100009813563_100000210206 [0,1,0,0,0,1|1,0,1]=4 4464 B12R1.233 Cc1ccc(c(c1)C)CC(=O)[13CH3] 1458a_100011236500_200025704644 [0,1,0,0,0,1|0,0,0]=2 4465 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 2230a_100025771030_200000210301 [0,1,0,0,0,1|2,0,0]=4 4466 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 2230a_100102631434_100011219618 [0,1,0,0,0,1|2,0,0]=4 4467 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 269982a_100025771030_200000210301 [0,1,0,0,0,1|2,0,0]=4 4468 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 269982a_100102631434_100011219618 [0,1,0,0,0,1|2,0,0]=4 4469 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 270004a_100102631434_100000211342 [0,1,0,0,0,1|2,0,0]=4 4470 B12R1.233 Cc1ccc(c(c1)C)CN(C)C 34a_100025771030_200000210301 [0,1,0,0,0,1|2,0,0]=4 4471 B12R1.233 Cc1ccc(c(c1)C)CN(C)[13CH3] 2230a_100025771030_200025704644 [0,1,0,0,0,1|2,0,0]=4 4472 B12R1.233 Cc1ccc(c(c1)C)CN(C)[13CH3] 269982a_100025771030_200025704644 [0,1,0,0,0,1|2,0,0]=4 4473 B12R1.233 Cc1ccc(c(c1)C)CN(C)[13CH3] 34a_100025771030_200025704644 [0,1,0,0,0,1|2,0,0]=4 4474 B12R1.233 Cc1ccc(c(c1)C)NC(C)C 34a_100000736561_100000210206 [0,1,0,0,0,1|1,0,1]=4 4475 B12R1.233 Cc1ccc(c(c1)C)NC(C)C 7a_100000736561_100000210206 [0,1,0,0,0,1|1,0,1]=4 4476 B12R1.233 Cc1ccc(c(c1)C)OC(C)C 34a_100000211776_100000210206 [0,1,0,0,0,1|1,0,1]=4 4477 B12R1.233 Cc1ccc(c(c1)C)OC(C)C 7a_100000211776_100000210206 [0,1,0,0,0,1|1,0,1]=4 4478 B12R1.233 Cc1ccc(c(c1)C)SC(C)C 62a_100000210206_100011217332 [0,1,0,0,0,1|1,0,1]=4 4479 B12R1.233 Cc1ccc(c(c1)C)SC(C)C 62a_100011217332_100000210206 [0,1,0,0,0,1|1,0,1]=4 4480 B12R1.233 Cc1ccc(c(c1)Cl)CN(C)C 2230a_100102631434_100012349684 [0,1,0,0,0,1|2,0,0]=4 4481 B12R1.233 Cc1ccc(c(c1)Cl)CN(C)C 269982a_100102631434_100012349684 [0,1,0,0,0,1|2,0,0]=4 4482 B12R1.233 Cc1ccc(c(c1)Cl)CN(C)C 270004a_100102631434_100011935181 [0,1,0,0,0,1|2,0,0]=4 4483 B12R1.233 Cc1ccc(c(c1)Cl)NC(C)C 34a_100000210522_100000210206 [0,1,0,0,0,1|1,0,1]=4 4484 B12R1.233 Cc1ccc(c(c1)Cl)OC(C)C 34a_100000749699_100000210206 [0,1,0,0,0,1|1,0,1]=4 4485 B12R1.233 Cc1ccc(c(c1)Cl)OC(C)C 7a_100000749699_100000210206 [0,1,0,0,0,1|1,0,1]=4 4486 B12R1.233 Cc1ccc(c(c1)Cl)SC(C)C 62a_100000210206_100011263221 [0,1,0,0,0,1|1,0,1]=4 4487 B12R1.233 Cc1ccc(c(c1)Cl)SC(C)C 62a_100011263221_100000210206 [0,1,0,0,0,1|1,0,1]=4 4488 B12R1.233 Cc1ccc(c(c1)F)CC(=O)[13CH3] 1458a_100000042674_200025704644 [0,1,0,0,0,1|0,0,0]=2 4489 B12R1.233 Cc1ccc(c(c1)F)CN(C)C 2230a_100102631434_100011217900 [0,1,0,0,0,1|2,0,0]=4 4490 B12R1.233 Cc1ccc(c(c1)F)CN(C)C 269982a_100102631434_100011217900 [0,1,0,0,0,1|2,0,0]=4 4491 B12R1.233 Cc1ccc(c(c1)F)CN(C)C 270004a_100102631434_100011217368 [0,1,0,0,0,1|2,0,0]=4 4492 B12R1.233 Cc1ccc(c(c1)F)NC(C)C 34a_100000211023_100000210206 [0,1,0,0,0,1|1,0,1]=4 4493 B12R1.233 Cc1ccc(c(c1)F)OC(C)C 34a_100011216688_100000210206 [0,1,0,0,0,1|1,0,1]=4 4494 B12R1.233 Cc1ccc(c(c1)F)OC(C)C 7a_100011216688_100000210206 [0,1,0,0,0,1|1,0,1]=4 4495 B12R1.233 Cc1ccc(c(c1)F)SC(C)C 62a_100000210206_100011216119 [0,1,0,0,0,1|1,0,1]=4 4496 B12R1.233 Cc1ccc(c(c1)F)SC(C)C 62a_100011216119_100000210206 [0,1,0,0,0,1|1,0,1]=4 4497 B12R1.233 Cc1ccc(c(c1)I)CN(C)C 270004a_100102631434_100010150104 [0,1,0,0,0,1|2,0,0]=4 4498 B12R1.233 Cc1ccc(c(c1)I)NC(C)C 34a_100011356834_100000210206 [0,1,0,0,0,1|1,0,1]=4 4499 B12R1.233 Cc1ccc(c(c1)I)OC(C)C 34a_100000765521_100000210206 [0,1,0,0,0,1|1,0,1]=4 4500 B12R1.233 Cc1ccc(c(c1)I)OC(C)C 7a_100000765521_100000210206 [0,1,0,0,0,1|1,0,1]=4 4501 B12R1.233 Cc1ccc(c(c1)N)OC(C)C 34a_100011215204_100000210206 [0,1,0,0,0,1|1,0,1]=4 4502 B12R1.233 Cc1ccc(c(c1)N)OC(C)C 7a_100011215204_100000210206 [0,1,0,0,0,1|1,0,1]=4 4503 B12R1.233 Cc1ccc(c(c1)N)SC(C)C 62a_100000210206_100011216686 [0,1,0,0,0,1|1,0,1]=4 4504 B12R1.233 Cc1ccc(c(c1)N)SC(C)C 62a_100011216686_100000210206 [0,1,0,0,0,1|1,0,1]=4 4505 B12R1.233 Cc1ccc(c(c1)O)NC(C)C 34a_100000211527_100000210206 [0,1,0,0,0,1|1,0,1]=4 4506 B12R1.233 Cc1ccc(c(c1)O)SC(C)C 62a_100000210206_100012002257 [0,1,0,0,0,1|1,0,1]=4 4507 B12R1.233 Cc1ccc(c(c1)O)SC(C)C 62a_100012002257_100000210206 [0,1,0,0,0,1|1,0,1]=4 4508 B12R1.233 Cc1ccn(c(=O)c1)CC(=O)[13CH3] 1458a_100000721392_200025704644 [0,1,0,0,0,1|1,0,0]=3 4509 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Br)Br 1458a_100010172832_200025704644 [0,1,0,0,0,1|1,0,0]=3 4510 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Br)Cl 1458a_100000755479_200025704644 [0,1,0,0,0,1|1,0,0]=3 4511 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Br)F 1458a_100000708238_200025704644 [0,1,0,0,0,1|1,0,0]=3 4512 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Br)O 1458a_100010176083_200025704644 [0,1,0,0,0,1|1,0,0]=3 4513 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Cl)Br 1458a_100012361378_200025704644 [0,1,0,0,0,1|1,0,0]=3 4514 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Cl)Cl 1458a_100000210926_200025704644 [0,1,0,0,0,1|1,0,0]=3 4515 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1Cl)F 1458a_100000690284_200025704644 [0,1,0,0,0,1|1,0,0]=3 4516 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)Br 1458a_100011295475_200025704644 [0,1,0,0,0,1|1,0,0]=3 4517 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)Cl 1458a_100011830378_200025704644 [0,1,0,0,0,1|1,0,0]=3 4518 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)F 1458a_100000684719_200025704644 [0,1,0,0,0,1|1,0,0]=3 4519 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)I 1458a_100010149628_200025704644 [0,1,0,0,0,1|1,0,0]=3 4520 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1F)O 1458a_100000090534_200025704644 [0,1,0,0,0,1|1,0,0]=3 4521 B12R1.233 [13CH3]C(=O)Cc1ccc(cc1O)Br 1458a_100000707504_200025704644 [0,1,0,0,0,1|1,0,0]=3 4522 B12R1.233 [13CH3]C(=O)Cc1ccc(nc1Cl)Cl 1458a_200010067290_200025704644 [0,1,0,0,0,1|2,0,0]=4 4523 B12R1.233 [13CH3]C(=O)Cc1ncc(cc1Br)Cl 1458a_200012351915_200025704644 [0,1,0,0,0,1|2,0,0]=4 4524 B12R1.233 [13CH3]C(=O)Cc1ncc(cc1F)Br 1458a_100012351917_200025704644 [0,1,0,0,0,1|2,0,0]=4 4525 B12R1.5 C#Cc1ccc(cc1)C(=O)CC 1458a_100011217615_100000210202 [0,2,0,0,0,0|0,0,1]=3 4526 B12R1.5 C#Cc1ccc(cc1)C(=O)CF 1458a_100011217615_100015361967 [0,2,0,0,0,0|0,0,1]=3 4527 B12R1.5 C#Cc1ccc(cc1)C(=O)NC 11a_106832991635_100011217615 [0,2,0,0,0,0|0,0,1]=3 4528 B12R1.5 C#Cc1ccc(cc1)C(=O)NC 1626a_100102657272_100011217615 [0,2,0,0,0,0|0,0,1]=3 4529 B12R1.5 C#Cc1ccc(cc1)C(=O)NC 240690a_100102657272_100011217615 [0,2,0,0,0,0|0,0,1]=3 4530 B12R1.5 C#Cc1ccc(cc1)C(=O)NC 527a_100102657272_100011217615 [0,2,0,0,0,0|0,0,1]=3 4531 B12R1.5 C=Cc1ccc(cc1)C(=O)C#N 271570a_100011290941_100009994572 [0,2,0,0,0,0|0,0,2]=4 4532 B12R1.5 C=Cc1ccc(cc1)C(=O)C=O 271570a_100011290941_100000725942 [0,2,0,0,0,0|0,0,2]=4 4533 B12R1.5 C=Cc1ccc(cc1)C(=O)CC 1458a_100000687532_100000210202 [0,2,0,0,0,0|0,0,1]=3 4534 B12R1.5 C=Cc1ccc(cc1)C(=O)CC 271570a_100011290941_100000211647 [0,2,0,0,0,0|0,0,1]=3 4535 B12R1.5 C=Cc1ccc(cc1)C(=O)CF 1458a_100000687532_100015361967 [0,2,0,0,0,0|0,0,1]=3 4536 B12R1.5 C=Cc1ccc(cc1)C(=O)CN 271570a_100011290941_100000017248 [0,2,0,0,0,0|0,0,1]=3 4537 B12R1.5 C=Cc1ccc(cc1)C(=O)CO 271570a_100011290941_100011219529 [0,2,0,0,0,0|0,0,1]=3 4538 B12R1.5 C=Cc1ccc(cc1)C(=O)NC 11a_106832991635_100000687532 [0,2,0,0,0,0|0,0,1]=3 4539 B12R1.5 C=Cc1ccc(cc1)C(=O)NC 1626a_100102657272_100000687532 [0,2,0,0,0,0|0,0,1]=3 4540 B12R1.5 C=Cc1ccc(cc1)C(=O)NC 240690a_100102657272_100000687532 [0,2,0,0,0,0|0,0,1]=3 4541 B12R1.5 C=Cc1ccc(cc1)C(=O)NC 271570a_100011290941_100000155074 [0,2,0,0,0,0|0,0,1]=3 4542 B12R1.5 C=Cc1ccc(cc1)C(=O)NC 527a_100102657272_100000687532 [0,2,0,0,0,0|0,0,1]=3 4543 B12R1.5 C=Cc1ccc(cc1)C(=O)NN 271570a_100011290941_100000183614 [0,2,0,0,0,0|1,0,1]=4 4544 B12R1.5 C=Cc1ccc(cc1)C(=O)OC 271570a_100011290941_100000150774 [0,2,0,0,0,0|0,0,1]=3 4545 B12R1.5 C=Cc1ccc(cn1)C(=O)NC 271570a_100011290941_100000159860 [0,2,0,0,0,0|1,0,1]=4 4546 B12R1.5 C=Cc1ccc(cn1)C(=O)OC 271570a_100011290941_100000733799 [0,2,0,0,0,0|1,0,1]=4 4547 B12R1.5 C=Cc1ccc(nc1)C(=O)CC 271570a_100011290941_100012351654 [0,2,0,0,0,0|1,0,1]=4 4548 B12R1.5 C=Cc1ccc(nc1)C(=O)NC 271570a_100011290941_100011781262 [0,2,0,0,0,0|1,0,1]=4 4549 B12R1.5 C=Cc1ccc(nc1)C(=O)OC 271570a_100011290941_100000690920 [0,2,0,0,0,0|1,0,1]=4 4550 B12R1.5 CC(=NO)c1ccc(cc1)O[13CH3] 34a_100000164205_200025704644 [0,2,0,0,0,0|0,0,1]=3 4551 B12R1.5 CC(C#N)c1ccc(cc1)N[13CH3] 34a_100000069498_200025704644 [0,2,0,0,0,0|1,0,1]=4 4552 B12R1.5 CC(C#N)c1ccc(cc1)N[13CH3] 7a_100000069498_200025704644 [0,2,0,0,0,0|1,0,1]=4 4553 B12R1.5 CC(C#N)c1ccc(cc1)S[13CH3] 62a_100000695319_200025704644 [0,2,0,0,0,0|1,0,1]=4 4554 B12R1.5 CC(C#N)c1ccc(cc1)S[13CH3] 62a_200025704644_100000695319 [0,2,0,0,0,0|1,0,1]=4 4555 B12R1.5 CC(CN)c1ccc(cc1)O[13CH3] 34a_200015188644_200025704644 [0,2,0,0,0,0|1,0,1]=4 4556 B12R1.5 CC(O[13CH3])c1ccc(cc1)CN 34a_200000048501_200025704644 [0,2,0,0,0,0|0,0,2]=4 4557 B12R1.5 CCC(=O)c1ccc(cc1)C#N 1458a_100000210717_100000210202 [0,2,0,0,0,0|0,0,1]=3 4558 B12R1.5 CCC(=O)c1ccc(cc1)CC 1458a_100000211226_100000210202 [0,2,0,0,0,0|0,0,0]=2 4559 B12R1.5 CCC(=O)c1ccc(cc1)CO 1458a_100000183892_100000210202 [0,2,0,0,0,0|0,0,0]=2 4560 B12R1.5 CCC(=O)c1ccc(cc1)OC 1458a_100000184203_100000210202 [0,2,0,0,0,0|0,0,0]=2 4561 B12R1.5 CCC(=O)c1ccc(cc1)OC 34a_100000212119_200000210301 [0,2,0,0,0,0|0,0,0]=2 4562 B12R1.5 CCC(=O)c1ccc(cc1)OC 7a_100000212119_200000210301 [0,2,0,0,0,0|0,0,0]=2 4563 B12R1.5 CCC(=O)c1ccc(cc1)O[13CH3] 34a_100000212119_200025704644 [0,2,0,0,0,0|0,0,0]=2 4564 B12R1.5 CCC(=O)c1ccc(cc1)O[13CH3] 7a_100000212119_200025704644 [0,2,0,0,0,0|0,0,0]=2 4565 B12R1.5 CCC(=O)c1ccc(cc1)SC 1458a_100000189692_100000210202 [0,2,0,0,0,0|0,0,0]=2 4566 B12R1.5 CCC(=O)c1ccc(cc1)SC 62a_100000211647_200000210301 [0,2,0,0,0,0|0,0,0]=2 4567 B12R1.5 CCC(=O)c1ccc(cc1)SC 62a_200000210301_100000211647 [0,2,0,0,0,0|0,0,0]=2 4568 B12R1.5 CCC(=O)c1ccc(cc1)S[13CH3] 62a_100000211647_200025704644 [0,2,0,0,0,0|0,0,0]=2 4569 B12R1.5 CCC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000211647 [0,2,0,0,0,0|0,0,0]=2 4570 B12R1.5 CCC(=O)c1ccc(cn1)SC 62a_100012351654_200000210301 [0,2,0,0,0,0|1,0,0]=3 4571 B12R1.5 CCC(=O)c1ccc(cn1)SC 62a_200000210301_100012351654 [0,2,0,0,0,0|1,0,0]=3 4572 B12R1.5 CCC(=O)c1ccc(cn1)S[13CH3] 62a_100012351654_200025704644 [0,2,0,0,0,0|1,0,0]=3 4573 B12R1.5 CCC(=O)c1ccc(cn1)S[13CH3] 62a_200025704644_100012351654 [0,2,0,0,0,0|1,0,0]=3 4574 B12R1.5 CCC(=O)c1ncc(cn1)SC 62a_200000210301_200010116844 [0,2,0,0,0,0|2,0,0]=4 4575 B12R1.5 CCC(=O)c1ncc(cn1)SC 62a_200010116844_200000210301 [0,2,0,0,0,0|2,0,0]=4 4576 B12R1.5 CCC(=O)c1ncc(cn1)S[13CH3] 62a_200010116844_200025704644 [0,2,0,0,0,0|2,0,0]=4 4577 B12R1.5 CCC(=O)c1ncc(cn1)S[13CH3] 62a_200025704644_200010116844 [0,2,0,0,0,0|2,0,0]=4 4578 B12R1.5 CCC(C)c1ccc(cc1)NC 2230a_100000211316_200000210301 [0,2,0,0,0,0|1,0,1]=4 4579 B12R1.5 CCC(C)c1ccc(cc1)NC 34a_100000211316_200000210301 [0,2,0,0,0,0|1,0,1]=4 4580 B12R1.5 CCC(C)c1ccc(cc1)NC 7a_100000211316_200000210301 [0,2,0,0,0,0|1,0,1]=4 4581 B12R1.5 CCC(C)c1ccc(cc1)N[13CH3] 2230a_100000211316_200025704644 [0,2,0,0,0,0|1,0,1]=4 4582 B12R1.5 CCC(C)c1ccc(cc1)N[13CH3] 34a_100000211316_200025704644 [0,2,0,0,0,0|1,0,1]=4 4583 B12R1.5 CCC(C)c1ccc(cc1)N[13CH3] 7a_100000211316_200025704644 [0,2,0,0,0,0|1,0,1]=4 4584 B12R1.5 CCC(C)c1ccc(cc1)OC 34a_100000211540_200000210301 [0,2,0,0,0,0|1,0,1]=4 4585 B12R1.5 CCC(C)c1ccc(cc1)OC 7a_100000211540_200000210301 [0,2,0,0,0,0|1,0,1]=4 4586 B12R1.5 CCC(C)c1ccc(cc1)O[13CH3] 34a_100000211540_200025704644 [0,2,0,0,0,0|1,0,1]=4 4587 B12R1.5 CCC(C)c1ccc(cc1)O[13CH3] 7a_100000211540_200025704644 [0,2,0,0,0,0|1,0,1]=4 4588 B12R1.5 CCC(C)c1ccc(cc1)SC 62a_100011221364_200000210301 [0,2,0,0,0,0|1,0,1]=4 4589 B12R1.5 CCC(C)c1ccc(cc1)SC 62a_200000210301_100011221364 [0,2,0,0,0,0|1,0,1]=4 4590 B12R1.5 CCC(C)c1ccc(cc1)S[13CH3] 62a_100011221364_200025704644 [0,2,0,0,0,0|1,0,1]=4 4591 B12R1.5 CCC(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100011221364 [0,2,0,0,0,0|1,0,1]=4 4592 B12R1.5 CCC(N)c1ccc(cc1)OC 34a_100015187210_200000210301 [0,2,0,0,0,0|1,0,1]=4 4593 B12R1.5 CCC(N)c1ccc(cc1)O[13CH3] 34a_100015187210_200025704644 [0,2,0,0,0,0|1,0,1]=4 4594 B12R1.5 CCC(O)c1ccc(cc1)SC 62a_100000246506_200000210301 [0,2,0,0,0,0|0,0,2]=4 4595 B12R1.5 CCC(O)c1ccc(cc1)SC 62a_200000210301_100000246506 [0,2,0,0,0,0|0,0,2]=4 4596 B12R1.5 CCC(O)c1ccc(cc1)S[13CH3] 62a_100000246506_200025704644 [0,2,0,0,0,0|0,0,2]=4 4597 B12R1.5 CCC(O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000246506 [0,2,0,0,0,0|0,0,2]=4 4598 B12R1.5 CCN(C)c1ccc(cc1)OC 2230a_100000220023_100000210202 [0,2,0,0,0,0|2,0,0]=4 4599 B12R1.5 CCN(C)c1ccc(cc1)OC 269982a_100000220023_100000204670 [0,2,0,0,0,0|2,0,0]=4 4600 B12R1.5 CCN(C)c1ccc(cc1)OC 34a_100000220023_100000210202 [0,2,0,0,0,0|2,0,0]=4 4601 B12R1.5 CC[C@H](N)c1ccc(cc1)SC 62a_100025736560_200000210301 [0,2,0,0,0,0|1,0,1]=4 4602 B12R1.5 CC[C@H](N)c1ccc(cc1)SC 62a_200000210301_100025736560 [0,2,0,0,0,0|1,0,1]=4 4603 B12R1.5 CC[C@H](N)c1ccc(cc1)S[13CH3] 62a_100025736560_200025704644 [0,2,0,0,0,0|1,0,1]=4 4604 B12R1.5 CC[C@H](N)c1ccc(cc1)S[13CH3] 62a_200025704644_100025736560 [0,2,0,0,0,0|1,0,1]=4 4605 B12R1.5 CCc1ccc(cc1)C(=O)CF 1458a_100000211226_100015361967 [0,2,0,0,0,0|0,0,0]=2 4606 B12R1.5 CCc1ccc(cc1)C(=O)NC 11a_106832991635_100000211226 [0,2,0,0,0,0|0,0,0]=2 4607 B12R1.5 CCc1ccc(cc1)C(=O)NC 1626a_100102657272_100000211226 [0,2,0,0,0,0|0,0,0]=2 4608 B12R1.5 CCc1ccc(cc1)C(=O)NC 240690a_100102657272_100000211226 [0,2,0,0,0,0|0,0,0]=2 4609 B12R1.5 CCc1ccc(cc1)C(=O)NC 527a_100102657272_100000211226 [0,2,0,0,0,0|0,0,0]=2 4610 B12R1.5 CCc1ccc(cc1)C(C)NC 2230a_100015186439_200000210301 [0,2,0,0,0,0|1,0,1]=4 4611 B12R1.5 CCc1ccc(cc1)C(C)NC 269862a_106832991636_100000211630 [0,2,0,0,0,0|1,0,1]=4 4612 B12R1.5 CCc1ccc(cc1)C(C)NC 34a_100015186439_200000210301 [0,2,0,0,0,0|1,0,1]=4 4613 B12R1.5 CCc1ccc(cc1)C(C)N[13CH3] 2230a_100015186439_200025704644 [0,2,0,0,0,0|1,0,1]=4 4614 B12R1.5 CCc1ccc(cc1)C(C)N[13CH3] 34a_100015186439_200025704644 [0,2,0,0,0,0|1,0,1]=4 4615 B12R1.5 CCc1ccc(cc1)C(C)OC 34a_100011232672_200000210301 [0,2,0,0,0,0|0,0,2]=4 4616 B12R1.5 CCc1ccc(cc1)C(C)OC 7a_100011232672_200000210301 [0,2,0,0,0,0|0,0,2]=4 4617 B12R1.5 CCc1ccc(cc1)C(C)O[13CH3] 34a_100011232672_200025704644 [0,2,0,0,0,0|0,0,2]=4 4618 B12R1.5 CCc1ccc(cc1)C(C)O[13CH3] 7a_100011232672_200025704644 [0,2,0,0,0,0|0,0,2]=4 4619 B12R1.5 CNC(=O)c1ccc(cc1)C#N 11a_106832991635_100000210717 [0,2,0,0,0,0|0,0,1]=3 4620 B12R1.5 CNC(=O)c1ccc(cc1)C#N 1626a_100102657272_100000210717 [0,2,0,0,0,0|0,0,1]=3 4621 B12R1.5 CNC(=O)c1ccc(cc1)C#N 240690a_100102657272_100000210717 [0,2,0,0,0,0|0,0,1]=3 4622 B12R1.5 CNC(=O)c1ccc(cc1)C#N 527a_100102657272_100000210717 [0,2,0,0,0,0|0,0,1]=3 4623 B12R1.5 CNC(=O)c1ccc(cc1)CO 1626a_100102657272_100000183892 [0,2,0,0,0,0|0,0,0]=2 4624 B12R1.5 CNC(=O)c1ccc(cc1)CO 240690a_100102657272_100000183892 [0,2,0,0,0,0|0,0,0]=2 4625 B12R1.5 CNC(=O)c1ccc(cc1)NC 2230a_100000184841_200000210301 [0,2,0,0,0,0|0,0,0]=2 4626 B12R1.5 CNC(=O)c1ccc(cc1)NC 27a_100102657272_100000155074 [0,2,0,0,0,0|0,0,0]=2 4627 B12R1.5 CNC(=O)c1ccc(cc1)NC 34a_100000184841_200000210301 [0,2,0,0,0,0|0,0,0]=2 4628 B12R1.5 CNC(=O)c1ccc(cc1)N[13CH3] 2230a_100000184841_200025704644 [0,2,0,0,0,0|0,0,0]=2 4629 B12R1.5 CNC(=O)c1ccc(cc1)N[13CH3] 34a_100000184841_200025704644 [0,2,0,0,0,0|0,0,0]=2 4630 B12R1.5 CNC(=O)c1ccc(cc1)OC 11a_106832991635_100000184203 [0,2,0,0,0,0|0,0,0]=2 4631 B12R1.5 CNC(=O)c1ccc(cc1)OC 1626a_100102657272_100000184203 [0,2,0,0,0,0|0,0,0]=2 4632 B12R1.5 CNC(=O)c1ccc(cc1)OC 240690a_100102657272_100000184203 [0,2,0,0,0,0|0,0,0]=2 4633 B12R1.5 CNC(=O)c1ccc(cc1)OC 34a_100000192141_200000210301 [0,2,0,0,0,0|0,0,0]=2 4634 B12R1.5 CNC(=O)c1ccc(cc1)OC 527a_100102657272_100000184203 [0,2,0,0,0,0|0,0,0]=2 4635 B12R1.5 CNC(=O)c1ccc(cc1)OC 7a_100000192141_200000210301 [0,2,0,0,0,0|0,0,0]=2 4636 B12R1.5 CNC(=O)c1ccc(cc1)O[13CH3] 34a_100000192141_200025704644 [0,2,0,0,0,0|0,0,0]=2 4637 B12R1.5 CNC(=O)c1ccc(cc1)O[13CH3] 7a_100000192141_200025704644 [0,2,0,0,0,0|0,0,0]=2 4638 B12R1.5 CNC(=O)c1ccc(cc1)SC 11a_106832991635_100000189692 [0,2,0,0,0,0|0,0,0]=2 4639 B12R1.5 CNC(=O)c1ccc(cc1)SC 1626a_100102657272_100000189692 [0,2,0,0,0,0|0,0,0]=2 4640 B12R1.5 CNC(=O)c1ccc(cc1)SC 240690a_100102657272_100000189692 [0,2,0,0,0,0|0,0,0]=2 4641 B12R1.5 CNC(=O)c1ccc(cc1)SC 527a_100102657272_100000189692 [0,2,0,0,0,0|0,0,0]=2 4642 B12R1.5 CNC(=O)c1ccc(cc1)SC 62a_100000155074_200000210301 [0,2,0,0,0,0|0,0,0]=2 4643 B12R1.5 CNC(=O)c1ccc(cc1)SC 62a_200000210301_100000155074 [0,2,0,0,0,0|0,0,0]=2 4644 B12R1.5 CNC(=O)c1ccc(cc1)S[13CH3] 62a_100000155074_200025704644 [0,2,0,0,0,0|0,0,0]=2 4645 B12R1.5 CNC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000155074 [0,2,0,0,0,0|0,0,0]=2 4646 B12R1.5 CNC(=O)c1ccc(cn1)NC 27a_100102657272_100011781262 [0,2,0,0,0,0|1,0,0]=3 4647 B12R1.5 CNC(=O)c1ccc(cn1)OC 34a_100009861314_200000210301 [0,2,0,0,0,0|1,0,0]=3 4648 B12R1.5 CNC(=O)c1ccc(cn1)OC 7a_100009861314_200000210301 [0,2,0,0,0,0|1,0,0]=3 4649 B12R1.5 CNC(=O)c1ccc(cn1)O[13CH3] 34a_100009861314_200025704644 [0,2,0,0,0,0|1,0,0]=3 4650 B12R1.5 CNC(=O)c1ccc(cn1)O[13CH3] 7a_100009861314_200025704644 [0,2,0,0,0,0|1,0,0]=3 4651 B12R1.5 CNC(=O)c1ccc(cn1)SC 62a_100011781262_200000210301 [0,2,0,0,0,0|1,0,0]=3 4652 B12R1.5 CNC(=O)c1ccc(cn1)SC 62a_200000210301_100011781262 [0,2,0,0,0,0|1,0,0]=3 4653 B12R1.5 CNC(=O)c1ccc(cn1)S[13CH3] 62a_100011781262_200025704644 [0,2,0,0,0,0|1,0,0]=3 4654 B12R1.5 CNC(=O)c1ccc(cn1)S[13CH3] 62a_200025704644_100011781262 [0,2,0,0,0,0|1,0,0]=3 4655 B12R1.5 CNC(=O)c1ccc(nc1)NC 27a_100102657272_100000159860 [0,2,0,0,0,0|1,0,0]=3 4656 B12R1.5 CNC(=O)c1ccc(nc1)SC 62a_100000159860_200000210301 [0,2,0,0,0,0|1,0,0]=3 4657 B12R1.5 CNC(=O)c1ccc(nc1)SC 62a_200000210301_100000159860 [0,2,0,0,0,0|1,0,0]=3 4658 B12R1.5 CNC(=O)c1ccc(nc1)S[13CH3] 62a_100000159860_200025704644 [0,2,0,0,0,0|1,0,0]=3 4659 B12R1.5 CNC(=O)c1ccc(nc1)S[13CH3] 62a_200025704644_100000159860 [0,2,0,0,0,0|1,0,0]=3 4660 B12R1.5 CNC(=O)c1ncc(cn1)NC 27a_100102657272_200010127873 [0,2,0,0,0,0|2,0,0]=4 4661 B12R1.5 CNC(=O)c1ncc(cn1)SC 62a_200000210301_200010127873 [0,2,0,0,0,0|2,0,0]=4 4662 B12R1.5 CNC(=O)c1ncc(cn1)SC 62a_200010127873_200000210301 [0,2,0,0,0,0|2,0,0]=4 4663 B12R1.5 CNC(=O)c1ncc(cn1)S[13CH3] 62a_200010127873_200025704644 [0,2,0,0,0,0|2,0,0]=4 4664 B12R1.5 CNC(=O)c1ncc(cn1)S[13CH3] 62a_200025704644_200010127873 [0,2,0,0,0,0|2,0,0]=4 4665 B12R1.5 CNC(C)c1ccc(cc1)CO 269862a_106832991636_100000082505 [0,2,0,0,0,0|1,0,1]=4 4666 B12R1.5 CNC(C)c1ccc(cc1)OC 269862a_106832991636_100000169859 [0,2,0,0,0,0|1,0,1]=4 4667 B12R1.5 CNC(C)c1ccc(cc1)SC 2230a_100000738722_200000210301 [0,2,0,0,0,0|1,0,1]=4 4668 B12R1.5 CNC(C)c1ccc(cc1)SC 269862a_106832991636_100000185071 [0,2,0,0,0,0|1,0,1]=4 4669 B12R1.5 CNC(C)c1ccc(cc1)SC 62a_100000231103_200000210301 [0,2,0,0,0,0|1,0,1]=4 4670 B12R1.5 CNC(C)c1ccc(cc1)SC 62a_200000210301_100000231103 [0,2,0,0,0,0|1,0,1]=4 4671 B12R1.5 CNC(C)c1ccc(cc1)S[13CH3] 62a_100000231103_200025704644 [0,2,0,0,0,0|1,0,1]=4 4672 B12R1.5 CNC(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100000231103 [0,2,0,0,0,0|1,0,1]=4 4673 B12R1.5 CN[C@H](C)c1ccc(cc1)OC 2230a_100011830352_200000210301 [0,2,0,0,0,0|1,0,1]=4 4674 B12R1.5 CNc1ccc(cc1)C(=O)NN 27a_100102657272_100000183614 [0,2,0,0,0,0|1,0,0]=3 4675 B12R1.5 CNc1ccc(cc1)C(C)C#N 34a_100000069498_200000210301 [0,2,0,0,0,0|1,0,1]=4 4676 B12R1.5 CNc1ccc(cc1)C(C)C#N 7a_100000069498_200000210301 [0,2,0,0,0,0|1,0,1]=4 4677 B12R1.5 CNc1ccc(cc1)C(C)NC 269862a_106832991636_100011806243 [0,2,0,0,0,0|1,0,1]=4 4678 B12R1.5 CNc1ccc(cn1)C(=O)NN 27a_100102657272_100000189807 [0,2,0,0,0,0|2,0,0]=4 4679 B12R1.5 CNc1ccc(cn1)C(=O)OC 27a_100102657272_100000733799 [0,2,0,0,0,0|1,0,0]=3 4680 B12R1.5 CNc1ccc(nn1)C(=O)OC 27a_100102657272_100000738951 [0,2,0,0,0,0|2,0,0]=4 4681 B12R1.5 CNc1cnc(cn1)C(=O)OC 27a_100102657272_100010219404 [0,2,0,0,0,0|2,0,0]=4 4682 B12R1.5 CNc1ncc(cn1)C(=O)OC 27a_100102657272_100000729365 [0,2,0,0,0,0|2,0,0]=4 4683 B12R1.5 COC(=O)c1ccc(cc1)OC 34a_100000150123_200000210301 [0,2,0,0,0,0|0,0,0]=2 4684 B12R1.5 COC(=O)c1ccc(cc1)OC 7a_100000150123_200000210301 [0,2,0,0,0,0|0,0,0]=2 4685 B12R1.5 COC(=O)c1ccc(cc1)O[13CH3] 34a_100000150123_200025704644 [0,2,0,0,0,0|0,0,0]=2 4686 B12R1.5 COC(=O)c1ccc(cc1)O[13CH3] 7a_100000150123_200025704644 [0,2,0,0,0,0|0,0,0]=2 4687 B12R1.5 COC(=O)c1ccc(cc1)SC 62a_100000150774_200000210301 [0,2,0,0,0,0|0,0,0]=2 4688 B12R1.5 COC(=O)c1ccc(cc1)SC 62a_200000210301_100000150774 [0,2,0,0,0,0|0,0,0]=2 4689 B12R1.5 COC(=O)c1ccc(cc1)S[13CH3] 62a_100000150774_200025704644 [0,2,0,0,0,0|0,0,0]=2 4690 B12R1.5 COC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000150774 [0,2,0,0,0,0|0,0,0]=2 4691 B12R1.5 COC(=O)c1ccc(cn1)OC 34a_100011997255_200000210301 [0,2,0,0,0,0|1,0,0]=3 4692 B12R1.5 COC(=O)c1ccc(cn1)OC 7a_100011997255_200000210301 [0,2,0,0,0,0|1,0,0]=3 4693 B12R1.5 COC(=O)c1ccc(cn1)O[13CH3] 34a_100011997255_200025704644 [0,2,0,0,0,0|1,0,0]=3 4694 B12R1.5 COC(=O)c1ccc(cn1)O[13CH3] 7a_100011997255_200025704644 [0,2,0,0,0,0|1,0,0]=3 4695 B12R1.5 COC(=O)c1ccc(cn1)SC 62a_100102712061_200000210301 [0,2,0,0,0,0|1,0,0]=3 4696 B12R1.5 COC(=O)c1ccc(cn1)SC 62a_200000210301_100102712061 [0,2,0,0,0,0|1,0,0]=3 4697 B12R1.5 COC(=O)c1ccc(cn1)S[13CH3] 62a_100102712061_200025704644 [0,2,0,0,0,0|1,0,0]=3 4698 B12R1.5 COC(=O)c1ccc(cn1)S[13CH3] 62a_200025704644_100102712061 [0,2,0,0,0,0|1,0,0]=3 4699 B12R1.5 COC(=O)c1ccc(nc1)SC 62a_100000733799_200000210301 [0,2,0,0,0,0|1,0,0]=3 4700 B12R1.5 COC(=O)c1ccc(nc1)SC 62a_200000210301_100000733799 [0,2,0,0,0,0|1,0,0]=3 4701 B12R1.5 COC(=O)c1ccc(nc1)S[13CH3] 62a_100000733799_200025704644 [0,2,0,0,0,0|1,0,0]=3 4702 B12R1.5 COC(=O)c1ccc(nc1)S[13CH3] 62a_200025704644_100000733799 [0,2,0,0,0,0|1,0,0]=3 4703 B12R1.5 COC(=O)c1ccc(nn1)SC 62a_100000738951_200000210301 [0,2,0,0,0,0|2,0,0]=4 4704 B12R1.5 COC(=O)c1ccc(nn1)SC 62a_200000210301_100000738951 [0,2,0,0,0,0|2,0,0]=4 4705 B12R1.5 COC(=O)c1ccc(nn1)S[13CH3] 62a_100000738951_200025704644 [0,2,0,0,0,0|2,0,0]=4 4706 B12R1.5 COC(=O)c1ccc(nn1)S[13CH3] 62a_200025704644_100000738951 [0,2,0,0,0,0|2,0,0]=4 4707 B12R1.5 COC(=O)c1cnc(cn1)SC 62a_100010219404_200000210301 [0,2,0,0,0,0|2,0,0]=4 4708 B12R1.5 COC(=O)c1cnc(cn1)SC 62a_200000210301_100010219404 [0,2,0,0,0,0|2,0,0]=4 4709 B12R1.5 COC(=O)c1cnc(cn1)S[13CH3] 62a_100010219404_200025704644 [0,2,0,0,0,0|2,0,0]=4 4710 B12R1.5 COC(=O)c1cnc(cn1)S[13CH3] 62a_200025704644_100010219404 [0,2,0,0,0,0|2,0,0]=4 4711 B12R1.5 COC(=O)c1cnc(nc1)SC 62a_100000729365_200000210301 [0,2,0,0,0,0|2,0,0]=4 4712 B12R1.5 COC(=O)c1cnc(nc1)SC 62a_200000210301_100000729365 [0,2,0,0,0,0|2,0,0]=4 4713 B12R1.5 COC(=O)c1cnc(nc1)S[13CH3] 62a_100000729365_200025704644 [0,2,0,0,0,0|2,0,0]=4 4714 B12R1.5 COC(=O)c1cnc(nc1)S[13CH3] 62a_200025704644_100000729365 [0,2,0,0,0,0|2,0,0]=4 4715 B12R1.5 COC(=O)c1ncc(cn1)SC 62a_100000690087_200000210301 [0,2,0,0,0,0|2,0,0]=4 4716 B12R1.5 COC(=O)c1ncc(cn1)SC 62a_200000210301_100000690087 [0,2,0,0,0,0|2,0,0]=4 4717 B12R1.5 COC(=O)c1ncc(cn1)S[13CH3] 62a_100000690087_200025704644 [0,2,0,0,0,0|2,0,0]=4 4718 B12R1.5 COC(=O)c1ncc(cn1)S[13CH3] 62a_200025704644_100000690087 [0,2,0,0,0,0|2,0,0]=4 4719 B12R1.5 COC(C)c1ccc(cc1)CN 34a_200000048501_200000210301 [0,2,0,0,0,0|0,0,2]=4 4720 B12R1.5 COC(C)c1ccc(cc1)O[13CH3] 34a_200010658654_200025704644 [0,2,0,0,0,0|0,0,2]=4 4721 B12R1.5 COC(C)c1ccc(cc1)O[13CH3] 7a_200010658654_200025704644 [0,2,0,0,0,0|0,0,2]=4 4722 B12R1.5 COC(C)c1ccc(cc1)SC 62a_100010254937_200000210301 [0,2,0,0,0,0|0,0,2]=4 4723 B12R1.5 COC(C)c1ccc(cc1)SC 62a_200000210301_100010254937 [0,2,0,0,0,0|0,0,2]=4 4724 B12R1.5 COC(C)c1ccc(cc1)S[13CH3] 62a_100010254937_200025704644 [0,2,0,0,0,0|0,0,2]=4 4725 B12R1.5 COC(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100010254937 [0,2,0,0,0,0|0,0,2]=4 4726 B12R1.5 COc1ccc(cc1)C(=NO)C 34a_100000164205_200000210301 [0,2,0,0,0,0|0,0,1]=3 4727 B12R1.5 COc1ccc(cc1)C(=NO)N 34a_100000231063_200000210301 [0,2,0,0,0,0|1,0,1]=4 4728 B12R1.5 COc1ccc(cc1)C(=O)CBr 7a_100009814261_200000210301 [0,2,0,0,0,0|0,0,0]=2 4729 B12R1.5 COc1ccc(cc1)C(=O)CCl 7a_100000018856_200000210301 [0,2,0,0,0,0|0,0,0]=2 4730 B12R1.5 COc1ccc(cc1)C(=O)CF 1458a_100000184203_100015361967 [0,2,0,0,0,0|0,0,0]=2 4731 B12R1.5 COc1ccc(cc1)C(=O)CF 34a_200010654591_200000210301 [0,2,0,0,0,0|0,0,0]=2 4732 B12R1.5 COc1ccc(cc1)C(=O)CF 7a_200010654591_200000210301 [0,2,0,0,0,0|0,0,0]=2 4733 B12R1.5 COc1ccc(cc1)C(=O)NN 34a_100000185078_200000210301 [0,2,0,0,0,0|1,0,0]=3 4734 B12R1.5 COc1ccc(cc1)C(C)CN 34a_200015188644_200000210301 [0,2,0,0,0,0|1,0,1]=4 4735 B12R1.5 COc1ccc(cc1)C(C)OC 34a_100000742907_200000210301 [0,2,0,0,0,0|0,0,2]=4 4736 B12R1.5 COc1ccc(cc1)C(C)OC 34a_200010658654_200000210301 [0,2,0,0,0,0|0,0,2]=4 4737 B12R1.5 COc1ccc(cc1)C(C)OC 7a_100000742907_200000210301 [0,2,0,0,0,0|0,0,2]=4 4738 B12R1.5 COc1ccc(cc1)C(C)OC 7a_200010658654_200000210301 [0,2,0,0,0,0|0,0,2]=4 4739 B12R1.5 COc1ccc(cc1)C(C)O[13CH3] 34a_100000742907_200025704644 [0,2,0,0,0,0|0,0,2]=4 4740 B12R1.5 COc1ccc(cc1)C(C)O[13CH3] 7a_100000742907_200025704644 [0,2,0,0,0,0|0,0,2]=4 4741 B12R1.5 COc1ccc(cc1)C(O)CN 34a_100000067596_200000210301 [0,2,0,0,0,0|0,0,2]=4 4742 B12R1.5 COc1ccc(cc1)N(C)CF 269982a_100000220023_100015361967 [0,2,0,0,0,0|2,0,0]=4 4743 B12R1.5 COc1ccc(cc1)N(C)CF 34a_100000220023_100015361967 [0,2,0,0,0,0|2,0,0]=4 4744 B12R1.5 COc1ccc(cc1)[C@@H](C)N[13CH3] 2230a_100011830352_200025704644 [0,2,0,0,0,0|1,0,1]=4 4745 B12R1.5 CSc1ccc(cc1)C(=O)C#N 62a_200000210301_100009994572 [0,2,0,0,0,0|0,0,1]=3 4746 B12R1.5 CSc1ccc(cc1)C(=O)C=O 62a_100000725942_200000210301 [0,2,0,0,0,0|0,0,1]=3 4747 B12R1.5 CSc1ccc(cc1)C(=O)C=O 62a_200000210301_100000725942 [0,2,0,0,0,0|0,0,1]=3 4748 B12R1.5 CSc1ccc(cc1)C(=O)CF 1458a_100000189692_100015361967 [0,2,0,0,0,0|0,0,0]=2 4749 B12R1.5 CSc1ccc(cc1)C(=O)CN 62a_100000017248_200000210301 [0,2,0,0,0,0|0,0,0]=2 4750 B12R1.5 CSc1ccc(cc1)C(=O)CN 62a_200000210301_100000017248 [0,2,0,0,0,0|0,0,0]=2 4751 B12R1.5 CSc1ccc(cc1)C(=O)CO 62a_100011219529_200000210301 [0,2,0,0,0,0|0,0,0]=2 4752 B12R1.5 CSc1ccc(cc1)C(=O)CO 62a_200000210301_100011219529 [0,2,0,0,0,0|0,0,0]=2 4753 B12R1.5 CSc1ccc(cc1)C(=O)NN 62a_100000183614_200000210301 [0,2,0,0,0,0|1,0,0]=3 4754 B12R1.5 CSc1ccc(cc1)C(=O)NN 62a_200000210301_100000183614 [0,2,0,0,0,0|1,0,0]=3 4755 B12R1.5 CSc1ccc(cc1)C(C)C#N 62a_100000695319_200000210301 [0,2,0,0,0,0|1,0,1]=4 4756 B12R1.5 CSc1ccc(cc1)C(C)C#N 62a_200000210301_100000695319 [0,2,0,0,0,0|1,0,1]=4 4757 B12R1.5 CSc1ccc(cc1)C(C)N[13CH3] 2230a_100000738722_200025704644 [0,2,0,0,0,0|1,0,1]=4 4758 B12R1.5 CSc1ccc(cc1)C(N)CO 62a_100000734186_200000210301 [0,2,0,0,0,0|1,0,1]=4 4759 B12R1.5 CSc1ccc(cc1)C(N)CO 62a_200000210301_100000734186 [0,2,0,0,0,0|1,0,1]=4 4760 B12R1.5 CSc1ccc(cc1)C(O)CN 62a_100020626992_200000210301 [0,2,0,0,0,0|0,0,2]=4 4761 B12R1.5 CSc1ccc(cc1)C(O)CN 62a_200000210301_100020626992 [0,2,0,0,0,0|0,0,2]=4 4762 B12R1.5 CSc1ccc(cc1)C(O)CO 62a_200000210301_200012355997 [0,2,0,0,0,0|0,0,2]=4 4763 B12R1.5 CSc1ccc(cc1)C(O)CO 62a_200012355997_200000210301 [0,2,0,0,0,0|0,0,2]=4 4764 B12R1.5 CSc1ccc(cn1)C(=O)NN 62a_100000189807_200000210301 [0,2,0,0,0,0|2,0,0]=4 4765 B12R1.5 CSc1ccc(cn1)C(=O)NN 62a_200000210301_100000189807 [0,2,0,0,0,0|2,0,0]=4 4766 B12R1.5 CSc1ccc(nc1)C(=O)NN 62a_100011781063_200000210301 [0,2,0,0,0,0|2,0,0]=4 4767 B12R1.5 CSc1ccc(nc1)C(=O)NN 62a_200000210301_100011781063 [0,2,0,0,0,0|2,0,0]=4 4768 B12R1.5 N#Cc1ccc(cc1)C(=O)CF 1458a_100000210717_100015361967 [0,2,0,0,0,0|0,0,1]=3 4769 B12R1.5 O=C(CF)c1ccc(cc1)CO 1458a_100000183892_100015361967 [0,2,0,0,0,0|0,0,0]=2 4770 B12R1.5 [13CH3]Oc1ccc(cc1)C(=NO)N 34a_100000231063_200025704644 [0,2,0,0,0,0|1,0,1]=4 4771 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)CBr 7a_100009814261_200025704644 [0,2,0,0,0,0|0,0,0]=2 4772 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)CCl 7a_100000018856_200025704644 [0,2,0,0,0,0|0,0,0]=2 4773 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)CF 34a_200010654591_200025704644 [0,2,0,0,0,0|0,0,0]=2 4774 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)CF 7a_200010654591_200025704644 [0,2,0,0,0,0|0,0,0]=2 4775 B12R1.5 [13CH3]Oc1ccc(cc1)C(=O)NN 34a_100000185078_200025704644 [0,2,0,0,0,0|1,0,0]=3 4776 B12R1.5 [13CH3]Oc1ccc(cc1)C(O)CN 34a_100000067596_200025704644 [0,2,0,0,0,0|0,0,2]=4 4777 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)C#N 62a_200025704644_100009994572 [0,2,0,0,0,0|0,0,1]=3 4778 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)C=O 62a_100000725942_200025704644 [0,2,0,0,0,0|0,0,1]=3 4779 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)C=O 62a_200025704644_100000725942 [0,2,0,0,0,0|0,0,1]=3 4780 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)CN 62a_100000017248_200025704644 [0,2,0,0,0,0|0,0,0]=2 4781 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)CN 62a_200025704644_100000017248 [0,2,0,0,0,0|0,0,0]=2 4782 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)CO 62a_100011219529_200025704644 [0,2,0,0,0,0|0,0,0]=2 4783 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)CO 62a_200025704644_100011219529 [0,2,0,0,0,0|0,0,0]=2 4784 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)NN 62a_100000183614_200025704644 [0,2,0,0,0,0|1,0,0]=3 4785 B12R1.5 [13CH3]Sc1ccc(cc1)C(=O)NN 62a_200025704644_100000183614 [0,2,0,0,0,0|1,0,0]=3 4786 B12R1.5 [13CH3]Sc1ccc(cc1)C(N)CO 62a_100000734186_200025704644 [0,2,0,0,0,0|1,0,1]=4 4787 B12R1.5 [13CH3]Sc1ccc(cc1)C(N)CO 62a_200025704644_100000734186 [0,2,0,0,0,0|1,0,1]=4 4788 B12R1.5 [13CH3]Sc1ccc(cc1)C(O)CN 62a_100020626992_200025704644 [0,2,0,0,0,0|0,0,2]=4 4789 B12R1.5 [13CH3]Sc1ccc(cc1)C(O)CN 62a_200025704644_100020626992 [0,2,0,0,0,0|0,0,2]=4 4790 B12R1.5 [13CH3]Sc1ccc(cc1)C(O)CO 62a_200012355997_200025704644 [0,2,0,0,0,0|0,0,2]=4 4791 B12R1.5 [13CH3]Sc1ccc(cc1)C(O)CO 62a_200025704644_200012355997 [0,2,0,0,0,0|0,0,2]=4 4792 B12R1.5 [13CH3]Sc1ccc(cn1)C(=O)NN 62a_100000189807_200025704644 [0,2,0,0,0,0|2,0,0]=4 4793 B12R1.5 [13CH3]Sc1ccc(cn1)C(=O)NN 62a_200025704644_100000189807 [0,2,0,0,0,0|2,0,0]=4 4794 B12R1.5 [13CH3]Sc1ccc(nc1)C(=O)NN 62a_100011781063_200025704644 [0,2,0,0,0,0|2,0,0]=4 4795 B12R1.5 [13CH3]Sc1ccc(nc1)C(=O)NN 62a_200025704644_100011781063 [0,2,0,0,0,0|2,0,0]=4 4796 B12R1.6 C=Cc1ccc(cc1)S(=O)(=O)C 271570a_100011290941_100000765142 [0,2,0,0,0,0|1,0,1]=4 4797 B12R1.6 CC(C)(C)c1ccc(cc1)N[13CH3] 2230a_100000210346_200025704644 [0,2,0,0,0,0|1,0,1]=4 4798 B12R1.6 CC(C)(C)c1ccc(cc1)N[13CH3] 34a_100000210346_200025704644 [0,2,0,0,0,0|1,0,1]=4 4799 B12R1.6 CC(C)(C)c1ccc(cc1)N[13CH3] 7a_100000210346_200025704644 [0,2,0,0,0,0|1,0,1]=4 4800 B12R1.6 CC(C)(C)c1ccc(cc1)O[13CH3] 34a_100000185729_200025704644 [0,2,0,0,0,0|1,0,1]=4 4801 B12R1.6 CC(C)(C)c1ccc(cc1)O[13CH3] 7a_100000185729_200025704644 [0,2,0,0,0,0|1,0,1]=4 4802 B12R1.6 CC(C)(C)c1ccc(cc1)S[13CH3] 62a_100011215385_200025704644 [0,2,0,0,0,0|1,0,1]=4 4803 B12R1.6 CC(C)(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100011215385 [0,2,0,0,0,0|1,0,1]=4 4804 B12R1.6 CC(C)(N)c1ccc(cc1)S[13CH3] 62a_100000739617_200025704644 [0,2,0,0,0,0|1,0,1]=4 4805 B12R1.6 CC(C)(N)c1ccc(cc1)S[13CH3] 62a_200025704644_100000739617 [0,2,0,0,0,0|1,0,1]=4 4806 B12R1.6 CC(C)(O)c1ccc(cc1)O[13CH3] 34a_100000695648_200025704644 [0,2,0,0,0,0|0,0,2]=4 4807 B12R1.6 CC(C)(O)c1ccc(cc1)O[13CH3] 7a_100000695648_200025704644 [0,2,0,0,0,0|0,0,2]=4 4808 B12R1.6 CC(C)(O)c1ccc(cc1)S[13CH3] 62a_100000753367_200025704644 [0,2,0,0,0,0|0,0,2]=4 4809 B12R1.6 CC(C)(O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000753367 [0,2,0,0,0,0|0,0,2]=4 4810 B12R1.6 CC(F)(F)c1ccc(cc1)S[13CH3] 62a_100009817129_200025704644 [0,2,0,0,0,0|1,0,1]=4 4811 B12R1.6 CC(F)(F)c1ccc(cc1)S[13CH3] 62a_200025704644_100009817129 [0,2,0,0,0,0|1,0,1]=4 4812 B12R1.6 CNc1ccc(cc1)C(C)(C)C 2230a_100000210346_200000210301 [0,2,0,0,0,0|1,0,1]=4 4813 B12R1.6 CNc1ccc(cc1)C(C)(C)C 34a_100000210346_200000210301 [0,2,0,0,0,0|1,0,1]=4 4814 B12R1.6 CNc1ccc(cc1)C(C)(C)C 7a_100000210346_200000210301 [0,2,0,0,0,0|1,0,1]=4 4815 B12R1.6 CNc1ccc(cc1)S(=O)(=O)C 34a_100000195502_200000210301 [0,2,0,0,0,0|1,0,0]=3 4816 B12R1.6 CNc1ccc(cc1)S(=O)(=O)C 7a_100000195502_200000210301 [0,2,0,0,0,0|1,0,0]=3 4817 B12R1.6 CNc1ccc(cc1)S(=O)(=O)N 34a_100000182716_200000210301 [0,2,0,0,0,0|2,0,0]=4 4818 B12R1.6 CNc1ccc(cc1)[Si](C)(C)C 7a_100009954384_200000210301 [0,2,0,0,0,0|1,1,0]=4 4819 B12R1.6 CNc1ccc(cn1)S(=O)(=O)C 27a_100102657272_100009816761 [0,2,0,0,0,0|2,0,0]=4 4820 B12R1.6 COc1ccc(cc1)C(C)(C)C 34a_100000185729_200000210301 [0,2,0,0,0,0|1,0,1]=4 4821 B12R1.6 COc1ccc(cc1)C(C)(C)C 7a_100000185729_200000210301 [0,2,0,0,0,0|1,0,1]=4 4822 B12R1.6 COc1ccc(cc1)C(C)(C)O 34a_100000695648_200000210301 [0,2,0,0,0,0|0,0,2]=4 4823 B12R1.6 COc1ccc(cc1)C(C)(C)O 7a_100000695648_200000210301 [0,2,0,0,0,0|0,0,2]=4 4824 B12R1.6 COc1ccc(cc1)S(=O)(=O)C 34a_100000230201_200000210301 [0,2,0,0,0,0|1,0,0]=3 4825 B12R1.6 COc1ccc(cc1)S(=O)(=O)C 7a_100000230201_200000210301 [0,2,0,0,0,0|1,0,0]=3 4826 B12R1.6 COc1ccc(cc1)S(=O)(=O)N 34a_100000738502_200000210301 [0,2,0,0,0,0|2,0,0]=4 4827 B12R1.6 COc1ccc(cc1)S(=O)(=O)N 7a_100000738502_200000210301 [0,2,0,0,0,0|2,0,0]=4 4828 B12R1.6 COc1ccc(cc1)S(=O)(=O)[O-] 7a_100000698548_200000210301 [0,2,0,0,0,0|2,0,0]=4 4829 B12R1.6 CS(=O)(=O)c1ccc(cc1)N[13CH3] 34a_100000195502_200025704644 [0,2,0,0,0,0|1,0,0]=3 4830 B12R1.6 CS(=O)(=O)c1ccc(cc1)N[13CH3] 7a_100000195502_200025704644 [0,2,0,0,0,0|1,0,0]=3 4831 B12R1.6 CS(=O)(=O)c1ccc(cc1)O[13CH3] 34a_100000230201_200025704644 [0,2,0,0,0,0|1,0,0]=3 4832 B12R1.6 CS(=O)(=O)c1ccc(cc1)O[13CH3] 7a_100000230201_200025704644 [0,2,0,0,0,0|1,0,0]=3 4833 B12R1.6 CS(=O)(=O)c1ccc(cc1)S[13CH3] 62a_100000765142_200025704644 [0,2,0,0,0,0|1,0,0]=3 4834 B12R1.6 CS(=O)(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000765142 [0,2,0,0,0,0|1,0,0]=3 4835 B12R1.6 CS(=O)(=O)c1ccc(cn1)S[13CH3] 62a_100009814649_200025704644 [0,2,0,0,0,0|2,0,0]=4 4836 B12R1.6 CS(=O)(=O)c1ccc(cn1)S[13CH3] 62a_200025704644_100009814649 [0,2,0,0,0,0|2,0,0]=4 4837 B12R1.6 CS(=O)(=O)c1ccc(nc1)S[13CH3] 62a_100009816761_200025704644 [0,2,0,0,0,0|2,0,0]=4 4838 B12R1.6 CS(=O)(=O)c1ccc(nc1)S[13CH3] 62a_200025704644_100009816761 [0,2,0,0,0,0|2,0,0]=4 4839 B12R1.6 CSc1ccc(cc1)C(C)(C)C 62a_100011215385_200000210301 [0,2,0,0,0,0|1,0,1]=4 4840 B12R1.6 CSc1ccc(cc1)C(C)(C)C 62a_200000210301_100011215385 [0,2,0,0,0,0|1,0,1]=4 4841 B12R1.6 CSc1ccc(cc1)C(C)(C)N 62a_100000739617_200000210301 [0,2,0,0,0,0|1,0,1]=4 4842 B12R1.6 CSc1ccc(cc1)C(C)(C)N 62a_200000210301_100000739617 [0,2,0,0,0,0|1,0,1]=4 4843 B12R1.6 CSc1ccc(cc1)C(C)(C)O 62a_100000753367_200000210301 [0,2,0,0,0,0|0,0,2]=4 4844 B12R1.6 CSc1ccc(cc1)C(C)(C)O 62a_200000210301_100000753367 [0,2,0,0,0,0|0,0,2]=4 4845 B12R1.6 CSc1ccc(cc1)C(C)(F)F 62a_100009817129_200000210301 [0,2,0,0,0,0|1,0,1]=4 4846 B12R1.6 CSc1ccc(cc1)C(C)(F)F 62a_200000210301_100009817129 [0,2,0,0,0,0|1,0,1]=4 4847 B12R1.6 CSc1ccc(cc1)S(=O)(=O)C 62a_100000765142_200000210301 [0,2,0,0,0,0|1,0,0]=3 4848 B12R1.6 CSc1ccc(cc1)S(=O)(=O)C 62a_200000210301_100000765142 [0,2,0,0,0,0|1,0,0]=3 4849 B12R1.6 CSc1ccc(cc1)S(=O)(=O)N 62a_100000701559_200000210301 [0,2,0,0,0,0|2,0,0]=4 4850 B12R1.6 CSc1ccc(cc1)S(=O)(=O)N 62a_200000210301_100000164505 [0,2,0,0,0,0|2,0,0]=4 4851 B12R1.6 CSc1ccc(cc1)[Si](C)(C)C 62a_100009813420_200000210301 [0,2,0,0,0,0|1,1,0]=4 4852 B12R1.6 CSc1ccc(cc1)[Si](C)(C)C 62a_200000210301_100009813420 [0,2,0,0,0,0|1,1,0]=4 4853 B12R1.6 CSc1ccc(cn1)S(=O)(=O)C 62a_100009816761_200000210301 [0,2,0,0,0,0|2,0,0]=4 4854 B12R1.6 CSc1ccc(cn1)S(=O)(=O)C 62a_200000210301_100009816761 [0,2,0,0,0,0|2,0,0]=4 4855 B12R1.6 CSc1ccc(nc1)S(=O)(=O)C 62a_100009814649_200000210301 [0,2,0,0,0,0|2,0,0]=4 4856 B12R1.6 CSc1ccc(nc1)S(=O)(=O)C 62a_200000210301_100009814649 [0,2,0,0,0,0|2,0,0]=4 4857 B12R1.6 C[Si](C)(C)c1ccc(cc1)N[13CH3] 7a_100009954384_200025704644 [0,2,0,0,0,0|1,1,0]=4 4858 B12R1.6 C[Si](C)(C)c1ccc(cc1)S[13CH3] 62a_100009813420_200025704644 [0,2,0,0,0,0|1,1,0]=4 4859 B12R1.6 C[Si](C)(C)c1ccc(cc1)S[13CH3] 62a_200025704644_100009813420 [0,2,0,0,0,0|1,1,0]=4 4860 B12R1.6 [13CH3]Nc1ccc(cc1)S(=O)(=O)N 34a_100000182716_200025704644 [0,2,0,0,0,0|2,0,0]=4 4861 B12R1.6 [13CH3]Oc1ccc(cc1)S(=O)(=O)N 34a_100000738502_200025704644 [0,2,0,0,0,0|2,0,0]=4 4862 B12R1.6 [13CH3]Oc1ccc(cc1)S(=O)(=O)N 7a_100000738502_200025704644 [0,2,0,0,0,0|2,0,0]=4 4863 B12R1.6 [13CH3]Oc1ccc(cc1)S(=O)(=O)[O-] 7a_100000698548_200025704644 [0,2,0,0,0,0|2,0,0]=4 4864 B12R1.6 [13CH3]Sc1ccc(cc1)S(=O)(=O)N 62a_100000701559_200025704644 [0,2,0,0,0,0|2,0,0]=4 4865 B12R1.6 [13CH3]Sc1ccc(cc1)S(=O)(=O)N 62a_200025704644_100000164505 [0,2,0,0,0,0|2,0,0]=4 4866 B12R1.48 C#Cc1ccc(cc1C)C(=O)C 1458a_100013243528_200000210301 [0,2,0,0,0,0|0,0,1]=3 4867 B12R1.48 C#Cc1ccc(cc1C)C(=O)[13CH3] 1458a_100013243528_200025704644 [0,2,0,0,0,0|0,0,1]=3 4868 B12R1.48 C#Cc1ccc(cc1Cl)C(=O)C 1458a_100014797261_200000210301 [0,2,0,0,0,0|0,0,1]=3 4869 B12R1.48 C#Cc1ccc(cc1Cl)C(=O)[13CH3] 1458a_100014797261_200025704644 [0,2,0,0,0,0|0,0,1]=3 4870 B12R1.48 C=C(C)c1cc(c(cn1)CO)C 271570a_100000694244_100010277336 [0,2,0,0,0,0|2,0,0]=4 4871 B12R1.48 C=C(C)c1cc(c(cn1)CO)N 271570a_100000694244_100009830438 [0,2,0,0,0,0|2,0,0]=4 4872 B12R1.48 C=C(C)c1cc(c(cn1)NC)N 271570a_100000694244_200015721873 [0,2,0,0,0,0|2,0,0]=4 4873 B12R1.48 C=C(C)c1cc(c(cn1)OC)N 271570a_100000694244_100010896307 [0,2,0,0,0,0|2,0,0]=4 4874 B12R1.48 C=C(C)c1cc(c(cn1)OC)O 271570a_100000694244_100010264082 [0,2,0,0,0,0|2,0,0]=4 4875 B12R1.48 C=C(C)c1ccc(c(c1)Br)C#N 271570a_100000694244_100012349582 [0,2,0,0,0,0|1,0,1]=4 4876 B12R1.48 C=C(C)c1ccc(c(c1)Br)C=O 271570a_100000694244_100010185650 [0,2,0,0,0,0|1,0,1]=4 4877 B12R1.48 C=C(C)c1ccc(c(c1)Br)CO 271570a_100000694244_100010240206 [0,2,0,0,0,0|1,0,0]=3 4878 B12R1.48 C=C(C)c1ccc(c(c1)Br)OC 271570a_100000694244_100011249507 [0,2,0,0,0,0|1,0,0]=3 4879 B12R1.48 C=C(C)c1ccc(c(c1)C)C#N 271570a_100000694244_100000687762 [0,2,0,0,0,0|1,0,1]=4 4880 B12R1.48 C=C(C)c1ccc(c(c1)C)C=O 271570a_100000694244_100000687586 [0,2,0,0,0,0|1,0,1]=4 4881 B12R1.48 C=C(C)c1ccc(c(c1)C)CF 271570a_100000694244_200010711859 [0,2,0,0,0,0|1,0,0]=3 4882 B12R1.48 C=C(C)c1ccc(c(c1)C)CN 271570a_100000694244_100000753881 [0,2,0,0,0,0|1,0,0]=3 4883 B12R1.48 C=C(C)c1ccc(c(c1)C)CO 271570a_100000694244_100000748258 [0,2,0,0,0,0|1,0,0]=3 4884 B12R1.48 C=C(C)c1ccc(c(c1)C)NC 271570a_100000694244_100000221803 [0,2,0,0,0,0|1,0,0]=3 4885 B12R1.48 C=C(C)c1ccc(c(c1)C)NN 271570a_100000694244_100000751375 [0,2,0,0,0,0|2,0,0]=4 4886 B12R1.48 C=C(C)c1ccc(c(c1)C)OC 271570a_100000694244_100011219705 [0,2,0,0,0,0|1,0,0]=3 4887 B12R1.48 C=C(C)c1ccc(c(c1)Cl)C#N 271570a_100000694244_100012349662 [0,2,0,0,0,0|1,0,1]=4 4888 B12R1.48 C=C(C)c1ccc(c(c1)Cl)C=O 271570a_100000694244_100000727542 [0,2,0,0,0,0|1,0,1]=4 4889 B12R1.48 C=C(C)c1ccc(c(c1)Cl)OC 271570a_100000694244_100012355395 [0,2,0,0,0,0|1,0,0]=3 4890 B12R1.48 C=C(C)c1ccc(c(c1)Cl)SC 271570a_100000694244_206447510565 [0,2,0,0,0,0|1,0,0]=3 4891 B12R1.48 C=C(C)c1ccc(c(c1)F)C#N 271570a_100000694244_100000037869 [0,2,0,0,0,0|1,0,1]=4 4892 B12R1.48 C=C(C)c1ccc(c(c1)F)C=O 271570a_100000694244_100000211676 [0,2,0,0,0,0|1,0,1]=4 4893 B12R1.48 C=C(C)c1ccc(c(c1)F)CC 271570a_100000694244_200010071577 [0,2,0,0,0,0|1,0,0]=3 4894 B12R1.48 C=C(C)c1ccc(c(c1)F)CN 271570a_100000694244_100000754580 [0,2,0,0,0,0|1,0,0]=3 4895 B12R1.48 C=C(C)c1ccc(c(c1)F)CO 271570a_100000694244_100011191541 [0,2,0,0,0,0|1,0,0]=3 4896 B12R1.48 C=C(C)c1ccc(c(c1)F)NC 271570a_100000694244_100000743884 [0,2,0,0,0,0|1,0,0]=3 4897 B12R1.48 C=C(C)c1ccc(c(c1)F)NN 271570a_100000694244_100000751572 [0,2,0,0,0,0|2,0,0]=4 4898 B12R1.48 C=C(C)c1ccc(c(c1)F)OC 271570a_100000694244_100000185480 [0,2,0,0,0,0|1,0,0]=3 4899 B12R1.48 C=C(C)c1ccc(c(c1)F)SC 271570a_100000694244_100010161220 [0,2,0,0,0,0|1,0,0]=3 4900 B12R1.48 C=C(C)c1ccc(c(c1)N)C#N 271570a_100000694244_100000699244 [0,2,0,0,0,0|1,0,1]=4 4901 B12R1.48 C=C(C)c1ccc(c(c1)N)C=O 271570a_100000694244_100009814810 [0,2,0,0,0,0|1,0,1]=4 4902 B12R1.48 C=C(C)c1ccc(c(c1)N)CC 271570a_100000694244_100012354963 [0,2,0,0,0,0|1,0,0]=3 4903 B12R1.48 C=C(C)c1ccc(c(c1)N)CO 271570a_100000694244_100000718831 [0,2,0,0,0,0|1,0,0]=3 4904 B12R1.48 C=C(C)c1ccc(c(c1)N)NC 271570a_100000694244_100000741790 [0,2,0,0,0,0|1,0,0]=3 4905 B12R1.48 C=C(C)c1ccc(c(c1)N)OC 271570a_100000694244_100000743470 [0,2,0,0,0,0|1,0,0]=3 4906 B12R1.48 C=C(C)c1ccc(c(c1)O)C#N 271570a_100000694244_100011934713 [0,2,0,0,0,0|1,0,1]=4 4907 B12R1.48 C=C(C)c1ccc(c(c1)O)C=O 271570a_100000694244_100011277552 [0,2,0,0,0,0|1,0,1]=4 4908 B12R1.48 C=C(C)c1ccc(c(c1)O)CO 271570a_100000694244_100000071718 [0,2,0,0,0,0|1,0,0]=3 4909 B12R1.48 C=C(C)c1ccc(c(c1)O)OC 271570a_100000694244_100009816560 [0,2,0,0,0,0|1,0,0]=3 4910 B12R1.48 C=C(C)c1ccc(c(n1)Br)OC 271570a_100000694244_100010214827 [0,2,0,0,0,0|2,0,0]=4 4911 B12R1.48 C=C(C)c1ccc(c(n1)C)OC 271570a_100000694244_100010244750 [0,2,0,0,0,0|2,0,0]=4 4912 B12R1.48 C=C(C)c1ccc(c(n1)Cl)OC 271570a_100000694244_100010233546 [0,2,0,0,0,0|2,0,0]=4 4913 B12R1.48 C=C(C)c1ccc(c(n1)F)CO 271570a_100000694244_100009870654 [0,2,0,0,0,0|2,0,0]=4 4914 B12R1.48 C=C(C)c1ccc(c(n1)F)OC 271570a_100000694244_100010138636 [0,2,0,0,0,0|2,0,0]=4 4915 B12R1.48 C=C(C)c1ccc(c(n1)N)OC 271570a_100000694244_100010192976 [0,2,0,0,0,0|2,0,0]=4 4916 B12R1.48 C=C(C)c1cnc(c(c1)Br)OC 271570a_100000694244_200010988584 [0,2,0,0,0,0|2,0,0]=4 4917 B12R1.48 C=C(C)c1cnc(c(c1)C)CO 271570a_100000694244_100010116297 [0,2,0,0,0,0|2,0,0]=4 4918 B12R1.48 C=C(C)c1cnc(c(c1)C)NC 271570a_100000694244_100012357622 [0,2,0,0,0,0|2,0,0]=4 4919 B12R1.48 C=C(C)c1cnc(c(c1)C)OC 271570a_100000694244_100011290809 [0,2,0,0,0,0|2,0,0]=4 4920 B12R1.48 C=C(C)c1cnc(c(c1)F)CN 271570a_100000694244_100015188786 [0,2,0,0,0,0|2,0,0]=4 4921 B12R1.48 C=C(C)c1cnc(c(c1)F)CO 271570a_100000694244_100010065252 [0,2,0,0,0,0|2,0,0]=4 4922 B12R1.48 C=C(C)c1cnc(c(c1)F)OC 271570a_100000694244_100011880707 [0,2,0,0,0,0|2,0,0]=4 4923 B12R1.48 C=C(C)c1cnc(c(c1)N)NC 271570a_100000694244_100011432983 [0,2,0,0,0,0|2,0,0]=4 4924 B12R1.48 C=C(C)c1cnc(c(c1)N)OC 271570a_100000694244_100000748608 [0,2,0,0,0,0|2,0,0]=4 4925 B12R1.48 C=C(C)c1cnc(c(c1)O)OC 271570a_100000694244_100010135713 [0,2,0,0,0,0|2,0,0]=4 4926 B12R1.48 C=Cc1ccc(cc1Br)C(=O)C 271570a_100011290941_100010146554 [0,2,0,0,0,0|0,0,1]=3 4927 B12R1.48 C=Cc1ccc(cc1Br)C(=O)N 271570a_100011290941_100009814583 [0,2,0,0,0,0|1,0,1]=4 4928 B12R1.48 C=Cc1ccc(cc1C)C(=O)C 271570a_100011290941_100000697869 [0,2,0,0,0,0|0,0,1]=3 4929 B12R1.48 C=Cc1ccc(cc1C)C(=O)N 271570a_100011290941_100011218126 [0,2,0,0,0,0|1,0,1]=4 4930 B12R1.48 C=Cc1ccc(cc1F)C(=O)C 271570a_100011290941_100000690002 [0,2,0,0,0,0|0,0,1]=3 4931 B12R1.48 C=Cc1ccc(cc1F)C(=O)N 271570a_100011290941_100000686215 [0,2,0,0,0,0|1,0,1]=4 4932 B12R1.48 C=Cc1ccc(cc1N)C(=O)C 271570a_100011290941_100009816534 [0,2,0,0,0,0|0,0,1]=3 4933 B12R1.48 C=Cc1ccc(cc1O)C(=O)N 271570a_100011290941_100012344895 [0,2,0,0,0,0|1,0,1]=4 4934 B12R1.48 C=Cc1cnc(cc1C)C(=O)C 271570a_100011290941_100011011822 [0,2,0,0,0,0|1,0,1]=4 4935 B12R1.48 C=Cc1ncc(cc1C)C(=O)C 271570a_100011290941_100009864263 [0,2,0,0,0,0|1,0,1]=4 4936 B12R1.48 CC(=O)c1cc(c(cn1)S[13CH3])C 62a_100011011822_200025704644 [0,2,0,0,0,0|1,0,0]=3 4937 B12R1.48 CC(=O)c1cc(c(cn1)S[13CH3])C 62a_200025704644_100011011822 [0,2,0,0,0,0|1,0,0]=3 4938 B12R1.48 CC(=O)c1ccc(c(c1)Br)C#N 1458a_100012355661_200000210301 [0,2,0,0,0,0|0,0,1]=3 4939 B12R1.48 CC(=O)c1ccc(c(c1)Br)O[13CH3] 34a_100011772453_200025704644 [0,2,0,0,0,0|0,0,0]=2 4940 B12R1.48 CC(=O)c1ccc(c(c1)Br)O[13CH3] 7a_100011772453_200025704644 [0,2,0,0,0,0|0,0,0]=2 4941 B12R1.48 CC(=O)c1ccc(c(c1)Br)S[13CH3] 62a_100010146554_200025704644 [0,2,0,0,0,0|0,0,0]=2 4942 B12R1.48 CC(=O)c1ccc(c(c1)Br)S[13CH3] 62a_200025704644_100010146554 [0,2,0,0,0,0|0,0,0]=2 4943 B12R1.48 CC(=O)c1ccc(c(c1)C)C#N 1458a_100012180287_200000210301 [0,2,0,0,0,0|0,0,1]=3 4944 B12R1.48 CC(=O)c1ccc(c(c1)C)O[13CH3] 34a_100000188726_200025704644 [0,2,0,0,0,0|0,0,0]=2 4945 B12R1.48 CC(=O)c1ccc(c(c1)C)O[13CH3] 7a_100000188726_200025704644 [0,2,0,0,0,0|0,0,0]=2 4946 B12R1.48 CC(=O)c1ccc(c(c1)C)S[13CH3] 62a_100000697869_200025704644 [0,2,0,0,0,0|0,0,0]=2 4947 B12R1.48 CC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200025704644_100000697869 [0,2,0,0,0,0|0,0,0]=2 4948 B12R1.48 CC(=O)c1ccc(c(c1)Cl)C#N 1458a_100000694585_200000210301 [0,2,0,0,0,0|0,0,1]=3 4949 B12R1.48 CC(=O)c1ccc(c(c1)Cl)O[13CH3] 34a_100000188625_200025704644 [0,2,0,0,0,0|0,0,0]=2 4950 B12R1.48 CC(=O)c1ccc(c(c1)Cl)O[13CH3] 7a_100000188625_200025704644 [0,2,0,0,0,0|0,0,0]=2 4951 B12R1.48 CC(=O)c1ccc(c(c1)F)C#N 1458a_100011217213_200000210301 [0,2,0,0,0,0|0,0,1]=3 4952 B12R1.48 CC(=O)c1ccc(c(c1)F)CO 1458a_100000687192_200000210301 [0,2,0,0,0,0|0,0,0]=2 4953 B12R1.48 CC(=O)c1ccc(c(c1)F)O[13CH3] 34a_100000751691_200025704644 [0,2,0,0,0,0|0,0,0]=2 4954 B12R1.48 CC(=O)c1ccc(c(c1)F)O[13CH3] 7a_100000751691_200025704644 [0,2,0,0,0,0|0,0,0]=2 4955 B12R1.48 CC(=O)c1ccc(c(c1)F)S[13CH3] 62a_100000690002_200025704644 [0,2,0,0,0,0|0,0,0]=2 4956 B12R1.48 CC(=O)c1ccc(c(c1)F)S[13CH3] 62a_200025704644_100000690002 [0,2,0,0,0,0|0,0,0]=2 4957 B12R1.48 CC(=O)c1ccc(c(c1)N)O[13CH3] 34a_100000117292_200025704644 [0,2,0,0,0,0|0,0,0]=2 4958 B12R1.48 CC(=O)c1ccc(c(c1)N)O[13CH3] 7a_100000117292_200025704644 [0,2,0,0,0,0|0,0,0]=2 4959 B12R1.48 CC(=O)c1ccc(c(c1)N)S[13CH3] 62a_100009816534_200025704644 [0,2,0,0,0,0|0,0,0]=2 4960 B12R1.48 CC(=O)c1cnc(c(c1)C)S[13CH3] 62a_100009864263_200025704644 [0,2,0,0,0,0|1,0,0]=3 4961 B12R1.48 CC(=O)c1cnc(c(c1)C)S[13CH3] 62a_200025704644_100009864263 [0,2,0,0,0,0|1,0,0]=3 4962 B12R1.48 CC(C)c1ccc(c(c1)Br)N[13CH3] 2230a_100011218581_200025704644 [0,2,0,0,0,0|1,0,1]=4 4963 B12R1.48 CC(C)c1ccc(c(c1)Br)N[13CH3] 34a_100011218581_200025704644 [0,2,0,0,0,0|1,0,1]=4 4964 B12R1.48 CC(C)c1ccc(c(c1)Br)N[13CH3] 7a_100011218581_200025704644 [0,2,0,0,0,0|1,0,1]=4 4965 B12R1.48 CC(C)c1ccc(c(c1)Br)S[13CH3] 62a_200010212211_200025704644 [0,2,0,0,0,0|1,0,1]=4 4966 B12R1.48 CC(C)c1ccc(c(c1)Br)S[13CH3] 62a_200025704644_200010212211 [0,2,0,0,0,0|1,0,1]=4 4967 B12R1.48 CC(C)c1ccc(c(c1)Cl)O[13CH3] 34a_100012182850_200025704644 [0,2,0,0,0,0|1,0,1]=4 4968 B12R1.48 CC(C)c1ccc(c(c1)Cl)O[13CH3] 7a_100012182850_200025704644 [0,2,0,0,0,0|1,0,1]=4 4969 B12R1.48 CC(C)c1ccc(c(c1)I)N[13CH3] 34a_100012355998_200025704644 [0,2,0,0,0,0|1,0,1]=4 4970 B12R1.48 CC(C)c1ccc(c(c1)I)N[13CH3] 7a_100012355998_200025704644 [0,2,0,0,0,0|1,0,1]=4 4971 B12R1.48 CC(C)c1ccc(c(c1)N)O[13CH3] 34a_200000187366_200025704644 [0,2,0,0,0,0|1,0,1]=4 4972 B12R1.48 CC(C)c1ccc(c(c1)N)O[13CH3] 7a_200000187366_200025704644 [0,2,0,0,0,0|1,0,1]=4 4973 B12R1.48 CCc1ccc(cc1Br)C(=O)C 1458a_100012340589_200000210301 [0,2,0,0,0,0|0,0,0]=2 4974 B12R1.48 CCc1ccc(cc1Br)C(=O)[13CH3] 1458a_100012340589_200025704644 [0,2,0,0,0,0|0,0,0]=2 4975 B12R1.48 CCc1ccc(cc1O)C(=O)C 1458a_100000089006_200000210301 [0,2,0,0,0,0|0,0,0]=2 4976 B12R1.48 CCc1ccc(cc1O)C(=O)[13CH3] 1458a_100000089006_200025704644 [0,2,0,0,0,0|0,0,0]=2 4977 B12R1.48 CN(C)c1ccc(c(c1)Br)N[13CH3] 34a_200013039233_200025704644 [0,2,0,0,0,0|2,0,0]=4 4978 B12R1.48 CNc1ccc(cc1Br)C(=O)N 27a_100102657272_100009814583 [0,2,0,0,0,0|1,0,0]=3 4979 B12R1.48 CNc1ccc(cc1Br)C(C)C 2230a_100011218581_200000210301 [0,2,0,0,0,0|1,0,1]=4 4980 B12R1.48 CNc1ccc(cc1Br)C(C)C 34a_100011218581_200000210301 [0,2,0,0,0,0|1,0,1]=4 4981 B12R1.48 CNc1ccc(cc1Br)C(C)C 7a_100011218581_200000210301 [0,2,0,0,0,0|1,0,1]=4 4982 B12R1.48 CNc1ccc(cc1Br)N(C)C 34a_200013039233_200000210301 [0,2,0,0,0,0|2,0,0]=4 4983 B12R1.48 CNc1ccc(cc1C)C(=O)N 27a_100102657272_100011218126 [0,2,0,0,0,0|1,0,0]=3 4984 B12R1.48 CNc1ccc(cc1C)C(=O)N 34a_100000746439_200000210301 [0,2,0,0,0,0|1,0,0]=3 4985 B12R1.48 CNc1ccc(cc1C)C(=O)N 7a_100000746439_200000210301 [0,2,0,0,0,0|1,0,0]=3 4986 B12R1.48 CNc1ccc(cc1C)N(C)C 34a_100000246174_200000210301 [0,2,0,0,0,0|2,0,0]=4 4987 B12R1.48 CNc1ccc(cc1C)[N+](=O)[O-] 2230a_100000184110_200000210301 [0,2,0,0,0,0|2,0,0]=4 4988 B12R1.48 CNc1ccc(cc1C)[N+](=O)[O-] 34a_100000184110_200000210301 [0,2,0,0,0,0|2,0,0]=4 4989 B12R1.48 CNc1ccc(cc1C)[N+](=O)[O-] 7a_100000184110_200000210301 [0,2,0,0,0,0|2,0,0]=4 4990 B12R1.48 CNc1ccc(cc1Cl)[N+](=O)[O-] 34a_100000185723_200000210301 [0,2,0,0,0,0|2,0,0]=4 4991 B12R1.48 CNc1ccc(cc1F)C(=O)N 27a_100102657272_100000686215 [0,2,0,0,0,0|1,0,0]=3 4992 B12R1.48 CNc1ccc(cc1F)[N+](=O)[O-] 34a_100000745739_200000210301 [0,2,0,0,0,0|2,0,0]=4 4993 B12R1.48 CNc1ccc(cc1I)C(C)C 34a_100012355998_200000210301 [0,2,0,0,0,0|1,0,1]=4 4994 B12R1.48 CNc1ccc(cc1I)C(C)C 7a_100012355998_200000210301 [0,2,0,0,0,0|1,0,1]=4 4995 B12R1.48 CNc1ncc(cc1C)C(=O)C 27a_100102657272_100009864263 [0,2,0,0,0,0|1,0,0]=3 4996 B12R1.48 COc1ccc(cc1Br)C(=O)C 1458a_100000187947_200000210301 [0,2,0,0,0,0|0,0,0]=2 4997 B12R1.48 COc1ccc(cc1Br)C(=O)C 34a_100011772453_200000210301 [0,2,0,0,0,0|0,0,0]=2 4998 B12R1.48 COc1ccc(cc1Br)C(=O)C 7a_100011772453_200000210301 [0,2,0,0,0,0|0,0,0]=2 4999 B12R1.48 COc1ccc(cc1Br)C(=O)[13CH3] 1458a_100000187947_200025704644 [0,2,0,0,0,0|0,0,0]=2 5000 B12R1.48 COc1ccc(cc1Br)[N+](=O)[O-] 34a_100000756651_200000210301 [0,2,0,0,0,0|2,0,0]=4 5001 B12R1.48 COc1ccc(cc1Br)[N+](=O)[O-] 7a_100000756651_200000210301 [0,2,0,0,0,0|2,0,0]=4 5002 B12R1.48 COc1ccc(cc1C)C(=O)C 1458a_100011202886_200000210301 [0,2,0,0,0,0|0,0,0]=2 5003 B12R1.48 COc1ccc(cc1C)C(=O)C 34a_100000188726_200000210301 [0,2,0,0,0,0|0,0,0]=2 5004 B12R1.48 COc1ccc(cc1C)C(=O)C 7a_100000188726_200000210301 [0,2,0,0,0,0|0,0,0]=2 5005 B12R1.48 COc1ccc(cc1C)C(=O)[13CH3] 1458a_100011202886_200025704644 [0,2,0,0,0,0|0,0,0]=2 5006 B12R1.48 COc1ccc(cc1C)C(C)C 34a_200012180908_200000210301 [0,2,0,0,0,0|1,0,1]=4 5007 B12R1.48 COc1ccc(cc1C)C(C)C 7a_200012180908_200000210301 [0,2,0,0,0,0|1,0,1]=4 5008 B12R1.48 COc1ccc(cc1C)[N+](=O)[O-] 34a_100000744956_200000210301 [0,2,0,0,0,0|2,0,0]=4 5009 B12R1.48 COc1ccc(cc1C)[N+](=O)[O-] 7a_100000744956_200000210301 [0,2,0,0,0,0|2,0,0]=4 5010 B12R1.48 COc1ccc(cc1Cl)C(=O)C 1458a_100000188346_200000210301 [0,2,0,0,0,0|0,0,0]=2 5011 B12R1.48 COc1ccc(cc1Cl)C(=O)C 34a_100000188625_200000210301 [0,2,0,0,0,0|0,0,0]=2 5012 B12R1.48 COc1ccc(cc1Cl)C(=O)C 7a_100000188625_200000210301 [0,2,0,0,0,0|0,0,0]=2 5013 B12R1.48 COc1ccc(cc1Cl)C(=O)N 34a_200000192832_200000210301 [0,2,0,0,0,0|1,0,0]=3 5014 B12R1.48 COc1ccc(cc1Cl)C(=O)N 7a_200000192832_200000210301 [0,2,0,0,0,0|1,0,0]=3 5015 B12R1.48 COc1ccc(cc1Cl)C(=O)[13CH3] 1458a_100000188346_200025704644 [0,2,0,0,0,0|0,0,0]=2 5016 B12R1.48 COc1ccc(cc1Cl)C(C)C 34a_100012182850_200000210301 [0,2,0,0,0,0|1,0,1]=4 5017 B12R1.48 COc1ccc(cc1Cl)C(C)C 7a_100012182850_200000210301 [0,2,0,0,0,0|1,0,1]=4 5018 B12R1.48 COc1ccc(cc1Cl)[N+](=O)[O-] 34a_100000206008_200000210301 [0,2,0,0,0,0|2,0,0]=4 5019 B12R1.48 COc1ccc(cc1Cl)[N+](=O)[O-] 7a_100000206008_200000210301 [0,2,0,0,0,0|2,0,0]=4 5020 B12R1.48 COc1ccc(cc1F)C(=O)C 1458a_100000186160_200000210301 [0,2,0,0,0,0|0,0,0]=2 5021 B12R1.48 COc1ccc(cc1F)C(=O)C 34a_100000751691_200000210301 [0,2,0,0,0,0|0,0,0]=2 5022 B12R1.48 COc1ccc(cc1F)C(=O)C 7a_100000751691_200000210301 [0,2,0,0,0,0|0,0,0]=2 5023 B12R1.48 COc1ccc(cc1F)C(=O)[13CH3] 1458a_100000186160_200025704644 [0,2,0,0,0,0|0,0,0]=2 5024 B12R1.48 COc1ccc(cc1F)[N+](=O)[O-] 34a_100000739697_200000210301 [0,2,0,0,0,0|2,0,0]=4 5025 B12R1.48 COc1ccc(cc1F)[N+](=O)[O-] 7a_100000739697_200000210301 [0,2,0,0,0,0|2,0,0]=4 5026 B12R1.48 COc1ccc(cc1I)C(=O)C 1458a_100000188716_200000210301 [0,2,0,0,0,0|0,0,0]=2 5027 B12R1.48 COc1ccc(cc1I)C(=O)[13CH3] 1458a_100000188716_200025704644 [0,2,0,0,0,0|0,0,0]=2 5028 B12R1.48 COc1ccc(cc1I)N(C)C 269982a_114948341033_200000210301 [0,2,0,0,0,0|2,0,0]=4 5029 B12R1.48 COc1ccc(cc1I)N(C)C 34a_114948341033_200000210301 [0,2,0,0,0,0|2,0,0]=4 5030 B12R1.48 COc1ccc(cc1I)N(C)C 38a_114948341033_200000210301 [0,2,0,0,0,0|2,0,0]=4 5031 B12R1.48 COc1ccc(cc1I)N(C)[13CH3] 269982a_114948341033_200025704644 [0,2,0,0,0,0|2,0,0]=4 5032 B12R1.48 COc1ccc(cc1I)N(C)[13CH3] 34a_114948341033_200025704644 [0,2,0,0,0,0|2,0,0]=4 5033 B12R1.48 COc1ccc(cc1I)N(C)[13CH3] 38a_114948341033_200025704644 [0,2,0,0,0,0|2,0,0]=4 5034 B12R1.48 COc1ccc(cc1I)[N+](=O)[O-] 34a_100012047213_200000210301 [0,2,0,0,0,0|2,0,0]=4 5035 B12R1.48 COc1ccc(cc1I)[N+](=O)[O-] 7a_100012047213_200000210301 [0,2,0,0,0,0|2,0,0]=4 5036 B12R1.48 COc1ccc(cc1N)C(=O)C 34a_100000117292_200000210301 [0,2,0,0,0,0|0,0,0]=2 5037 B12R1.48 COc1ccc(cc1N)C(=O)C 7a_100000117292_200000210301 [0,2,0,0,0,0|0,0,0]=2 5038 B12R1.48 COc1ccc(cc1N)C(C)C 34a_200000187366_200000210301 [0,2,0,0,0,0|1,0,1]=4 5039 B12R1.48 COc1ccc(cc1N)C(C)C 7a_200000187366_200000210301 [0,2,0,0,0,0|1,0,1]=4 5040 B12R1.48 COc1ccc(cc1N)[N+](=O)[O-] 34a_100000181223_200000210301 [0,2,0,0,0,0|2,0,0]=4 5041 B12R1.48 COc1ccc(cc1N)[N+](=O)[O-] 7a_100000181223_200000210301 [0,2,0,0,0,0|2,0,0]=4 5042 B12R1.48 COc1ccc(cc1O)C(=O)C 1458a_100000766810_200000210301 [0,2,0,0,0,0|0,0,0]=2 5043 B12R1.48 COc1ccc(cc1O)C(=O)C 271570a_203496583355_100000185153 [0,2,0,0,0,0|0,0,0]=2 5044 B12R1.48 COc1ccc(cc1O)C(=O)[13CH3] 1458a_100000766810_200025704644 [0,2,0,0,0,0|0,0,0]=2 5045 B12R1.48 COc1ccc(cc1O)C(C)O 271570a_203496583355_100000246541 [0,2,0,0,0,0|0,0,2]=4 5046 B12R1.48 CSc1ccc(cc1Br)C(=O)C 62a_100010146554_200000210301 [0,2,0,0,0,0|0,0,0]=2 5047 B12R1.48 CSc1ccc(cc1Br)C(=O)C 62a_200000210301_100010146554 [0,2,0,0,0,0|0,0,0]=2 5048 B12R1.48 CSc1ccc(cc1Br)C(=O)N 62a_100009814583_200000210301 [0,2,0,0,0,0|1,0,0]=3 5049 B12R1.48 CSc1ccc(cc1Br)C(=O)N 62a_200000210301_100009814583 [0,2,0,0,0,0|1,0,0]=3 5050 B12R1.48 CSc1ccc(cc1Br)C(C)C 62a_200000210301_200010212211 [0,2,0,0,0,0|1,0,1]=4 5051 B12R1.48 CSc1ccc(cc1Br)C(C)C 62a_200010212211_200000210301 [0,2,0,0,0,0|1,0,1]=4 5052 B12R1.48 CSc1ccc(cc1C)C(=O)C 62a_100000697869_200000210301 [0,2,0,0,0,0|0,0,0]=2 5053 B12R1.48 CSc1ccc(cc1C)C(=O)C 62a_200000210301_100000697869 [0,2,0,0,0,0|0,0,0]=2 5054 B12R1.48 CSc1ccc(cc1C)C(=O)N 62a_100011218126_200000210301 [0,2,0,0,0,0|1,0,0]=3 5055 B12R1.48 CSc1ccc(cc1C)C(=O)N 62a_200000210301_100011218126 [0,2,0,0,0,0|1,0,0]=3 5056 B12R1.48 CSc1ccc(cc1C)N(C)C 62a_100011934168_200000210301 [0,2,0,0,0,0|2,0,0]=4 5057 B12R1.48 CSc1ccc(cc1C)N(C)C 62a_200000210301_100011934168 [0,2,0,0,0,0|2,0,0]=4 5058 B12R1.48 CSc1ccc(cc1F)C(=O)C 62a_100000690002_200000210301 [0,2,0,0,0,0|0,0,0]=2 5059 B12R1.48 CSc1ccc(cc1F)C(=O)C 62a_200000210301_100000690002 [0,2,0,0,0,0|0,0,0]=2 5060 B12R1.48 CSc1ccc(cc1F)C(=O)N 62a_100000686215_200000210301 [0,2,0,0,0,0|1,0,0]=3 5061 B12R1.48 CSc1ccc(cc1F)C(=O)N 62a_200000210301_100000686215 [0,2,0,0,0,0|1,0,0]=3 5062 B12R1.48 CSc1ccc(cc1F)[C@H](C)N 62a_100134618348_200000210301 [0,2,0,0,0,0|1,0,1]=4 5063 B12R1.48 CSc1ccc(cc1F)[C@H](C)N 62a_200000210301_100134618348 [0,2,0,0,0,0|1,0,1]=4 5064 B12R1.48 CSc1ccc(cc1N)C(=O)C 62a_100009816534_200000210301 [0,2,0,0,0,0|0,0,0]=2 5065 B12R1.48 CSc1ccc(cc1O)C(=O)N 62a_100012344895_200000210301 [0,2,0,0,0,0|1,0,0]=3 5066 B12R1.48 CSc1ccc(cc1O)C(=O)N 62a_200000210301_100012344895 [0,2,0,0,0,0|1,0,0]=3 5067 B12R1.48 CSc1cnc(cc1C)C(=O)C 62a_100011011822_200000210301 [0,2,0,0,0,0|1,0,0]=3 5068 B12R1.48 CSc1cnc(cc1C)C(=O)C 62a_200000210301_100011011822 [0,2,0,0,0,0|1,0,0]=3 5069 B12R1.48 CSc1ncc(cc1C)C(=O)C 62a_100009864263_200000210301 [0,2,0,0,0,0|1,0,0]=3 5070 B12R1.48 CSc1ncc(cc1C)C(=O)C 62a_200000210301_100009864263 [0,2,0,0,0,0|1,0,0]=3 5071 B12R1.48 C[C@H](N)c1ccc(c(c1)F)S[13CH3] 62a_100134618348_200025704644 [0,2,0,0,0,0|1,0,1]=4 5072 B12R1.48 C[C@H](N)c1ccc(c(c1)F)S[13CH3] 62a_200025704644_100134618348 [0,2,0,0,0,0|1,0,1]=4 5073 B12R1.48 Cc1cc(ccc1C#N)C(=O)[13CH3] 1458a_100012180287_200025704644 [0,2,0,0,0,0|0,0,1]=3 5074 B12R1.48 Cc1cc(ccc1N[13CH3])C(=O)N 34a_100000746439_200025704644 [0,2,0,0,0,0|1,0,0]=3 5075 B12R1.48 Cc1cc(ccc1N[13CH3])C(=O)N 7a_100000746439_200025704644 [0,2,0,0,0,0|1,0,0]=3 5076 B12R1.48 Cc1cc(ccc1N[13CH3])N(C)C 34a_100000246174_200025704644 [0,2,0,0,0,0|2,0,0]=4 5077 B12R1.48 Cc1cc(ccc1N[13CH3])[N+](=O)[O-] 2230a_100000184110_200025704644 [0,2,0,0,0,0|2,0,0]=4 5078 B12R1.48 Cc1cc(ccc1N[13CH3])[N+](=O)[O-] 34a_100000184110_200025704644 [0,2,0,0,0,0|2,0,0]=4 5079 B12R1.48 Cc1cc(ccc1N[13CH3])[N+](=O)[O-] 7a_100000184110_200025704644 [0,2,0,0,0,0|2,0,0]=4 5080 B12R1.48 Cc1cc(ccc1O[13CH3])C(C)C 34a_200012180908_200025704644 [0,2,0,0,0,0|1,0,1]=4 5081 B12R1.48 Cc1cc(ccc1O[13CH3])C(C)C 7a_200012180908_200025704644 [0,2,0,0,0,0|1,0,1]=4 5082 B12R1.48 Cc1cc(ccc1O[13CH3])[N+](=O)[O-] 34a_100000744956_200025704644 [0,2,0,0,0,0|2,0,0]=4 5083 B12R1.48 Cc1cc(ccc1O[13CH3])[N+](=O)[O-] 7a_100000744956_200025704644 [0,2,0,0,0,0|2,0,0]=4 5084 B12R1.48 Cc1cc(ccc1S[13CH3])C(=O)N 62a_100011218126_200025704644 [0,2,0,0,0,0|1,0,0]=3 5085 B12R1.48 Cc1cc(ccc1S[13CH3])C(=O)N 62a_200025704644_100011218126 [0,2,0,0,0,0|1,0,0]=3 5086 B12R1.48 Cc1cc(ccc1S[13CH3])N(C)C 62a_100011934168_200025704644 [0,2,0,0,0,0|2,0,0]=4 5087 B12R1.48 Cc1cc(ccc1S[13CH3])N(C)C 62a_200025704644_100011934168 [0,2,0,0,0,0|2,0,0]=4 5088 B12R1.48 [13CH3]C(=O)c1ccc(c(c1)Br)C#N 1458a_100012355661_200025704644 [0,2,0,0,0,0|0,0,1]=3 5089 B12R1.48 [13CH3]C(=O)c1ccc(c(c1)Cl)C#N 1458a_100000694585_200025704644 [0,2,0,0,0,0|0,0,1]=3 5090 B12R1.48 [13CH3]C(=O)c1ccc(c(c1)F)C#N 1458a_100011217213_200025704644 [0,2,0,0,0,0|0,0,1]=3 5091 B12R1.48 [13CH3]C(=O)c1ccc(c(c1)F)CO 1458a_100000687192_200025704644 [0,2,0,0,0,0|0,0,0]=2 5092 B12R1.48 [13CH3]Nc1ccc(cc1Cl)[N+](=O)[O-] 34a_100000185723_200025704644 [0,2,0,0,0,0|2,0,0]=4 5093 B12R1.48 [13CH3]Nc1ccc(cc1F)[N+](=O)[O-] 34a_100000745739_200025704644 [0,2,0,0,0,0|2,0,0]=4 5094 B12R1.48 [13CH3]Oc1ccc(cc1Br)[N+](=O)[O-] 34a_100000756651_200025704644 [0,2,0,0,0,0|2,0,0]=4 5095 B12R1.48 [13CH3]Oc1ccc(cc1Br)[N+](=O)[O-] 7a_100000756651_200025704644 [0,2,0,0,0,0|2,0,0]=4 5096 B12R1.48 [13CH3]Oc1ccc(cc1Cl)C(=O)N 34a_200000192832_200025704644 [0,2,0,0,0,0|1,0,0]=3 5097 B12R1.48 [13CH3]Oc1ccc(cc1Cl)C(=O)N 7a_200000192832_200025704644 [0,2,0,0,0,0|1,0,0]=3 5098 B12R1.48 [13CH3]Oc1ccc(cc1Cl)[N+](=O)[O-] 34a_100000206008_200025704644 [0,2,0,0,0,0|2,0,0]=4 5099 B12R1.48 [13CH3]Oc1ccc(cc1Cl)[N+](=O)[O-] 7a_100000206008_200025704644 [0,2,0,0,0,0|2,0,0]=4 5100 B12R1.48 [13CH3]Oc1ccc(cc1F)[N+](=O)[O-] 34a_100000739697_200025704644 [0,2,0,0,0,0|2,0,0]=4 5101 B12R1.48 [13CH3]Oc1ccc(cc1F)[N+](=O)[O-] 7a_100000739697_200025704644 [0,2,0,0,0,0|2,0,0]=4 5102 B12R1.48 [13CH3]Oc1ccc(cc1I)[N+](=O)[O-] 34a_100012047213_200025704644 [0,2,0,0,0,0|2,0,0]=4 5103 B12R1.48 [13CH3]Oc1ccc(cc1I)[N+](=O)[O-] 7a_100012047213_200025704644 [0,2,0,0,0,0|2,0,0]=4 5104 B12R1.48 [13CH3]Oc1ccc(cc1N)[N+](=O)[O-] 34a_100000181223_200025704644 [0,2,0,0,0,0|2,0,0]=4 5105 B12R1.48 [13CH3]Oc1ccc(cc1N)[N+](=O)[O-] 7a_100000181223_200025704644 [0,2,0,0,0,0|2,0,0]=4 5106 B12R1.48 [13CH3]Sc1ccc(cc1Br)C(=O)N 62a_100009814583_200025704644 [0,2,0,0,0,0|1,0,0]=3 5107 B12R1.48 [13CH3]Sc1ccc(cc1Br)C(=O)N 62a_200025704644_100009814583 [0,2,0,0,0,0|1,0,0]=3 5108 B12R1.48 [13CH3]Sc1ccc(cc1F)C(=O)N 62a_100000686215_200025704644 [0,2,0,0,0,0|1,0,0]=3 5109 B12R1.48 [13CH3]Sc1ccc(cc1F)C(=O)N 62a_200025704644_100000686215 [0,2,0,0,0,0|1,0,0]=3 5110 B12R1.48 [13CH3]Sc1ccc(cc1O)C(=O)N 62a_100012344895_200025704644 [0,2,0,0,0,0|1,0,0]=3 5111 B12R1.48 [13CH3]Sc1ccc(cc1O)C(=O)N 62a_200025704644_100012344895 [0,2,0,0,0,0|1,0,0]=3 5112 B12R1.113 C=C(C)c1ccc(cc1)/C=C/Br 271570a_100000694244_200016255901 [0,2,0,0,0,0|1,0,1]=4 5113 B12R1.113 C=C(C)c1ccc(cc1)/C=C/C 271570a_100000694244_100016259036 [0,2,0,0,0,0|1,0,0]=3 5114 B12R1.113 C=C(C)c1ccc(cc1)C=CC 271570a_100016259895_100000185454 [0,2,0,0,0,0|1,0,0]=3 5115 B12R1.113 C=C(C)c1ccc(cc1)CC#N 271570a_100000694244_100011217881 [0,2,0,0,0,0|1,0,0]=3 5116 B12R1.113 C=C(C)c1ccc(cc1)CC=O 271570a_100000694244_100011361690 [0,2,0,0,0,0|1,0,0]=3 5117 B12R1.113 C=C(C)c1ccc(cc1)CCC 271570a_100000694244_100000750032 [0,2,0,0,0,0|1,0,0]=3 5118 B12R1.113 C=C(C)c1ccc(cc1)CCN 271570a_100000694244_100000755846 [0,2,0,0,0,0|1,0,0]=3 5119 B12R1.113 C=C(C)c1ccc(cc1)CCO 271570a_100000694244_100000766406 [0,2,0,0,0,0|1,0,0]=3 5120 B12R1.113 C=C(C)c1ccc(cc1)CNC 26a_100102657272_100009880102 [0,2,0,0,0,0|1,0,0]=3 5121 B12R1.113 C=C(C)c1ccc(cc1)CNC 271570a_100000694244_100000180866 [0,2,0,0,0,0|1,0,0]=3 5122 B12R1.113 C=C(C)c1ccc(cc1)CNN 271570a_100000694244_100016993955 [0,2,0,0,0,0|1,0,0]=3 5123 B12R1.113 C=C(C)c1ccc(cc1)COC 271570a_100000694244_100011493685 [0,2,0,0,0,0|1,0,0]=3 5124 B12R1.113 C=C(C)c1ccc(cc1)N=[N+]=[N-] 271570a_100000694244_100000735661 [0,2,0,0,0,0|2,0,0]=4 5125 B12R1.113 C=C(C)c1ccc(cc1)NC#N 271570a_100000694244_100011685341 [0,2,0,0,0,0|1,0,1]=4 5126 B12R1.113 C=C(C)c1ccc(cc1)NCC 271570a_100000694244_100000219632 [0,2,0,0,0,0|1,0,0]=3 5127 B12R1.113 C=C(C)c1ccc(cc1)OCC 271570a_100000694244_100000169946 [0,2,0,0,0,0|1,0,0]=3 5128 B12R1.113 C=C(C)c1ccc(cc1)OCC 34a_100009880102_100000210202 [0,2,0,0,0,0|1,0,0]=3 5129 B12R1.113 C=C(C)c1ccc(cc1)OCC 7a_100009880102_100000210202 [0,2,0,0,0,0|1,0,0]=3 5130 B12R1.113 C=C(C)c1ccc(cc1)OCF 34a_100009880102_100015361967 [0,2,0,0,0,0|1,0,0]=3 5131 B12R1.113 C=C(C)c1ccc(cc1)OCF 7a_100009880102_100015361967 [0,2,0,0,0,0|1,0,0]=3 5132 B12R1.113 C=C(C)c1ccc(cc1)SCC 271570a_100000694244_200009811893 [0,2,0,0,0,0|1,0,0]=3 5133 B12R1.113 C=C(C)c1ccc(cc1)SCC 62a_100000185454_100000210202 [0,2,0,0,0,0|1,0,0]=3 5134 B12R1.113 C=C(C)c1ccc(cc1)SCC 62a_100000210202_100000185454 [0,2,0,0,0,0|1,0,0]=3 5135 B12R1.113 C=C(C)c1ccc(cc1)SCF 62a_100000185454_100015361967 [0,2,0,0,0,0|1,0,0]=3 5136 B12R1.113 C=C(C)c1ccc(cc1)SCF 62a_100015361967_100000185454 [0,2,0,0,0,0|1,0,0]=3 5137 B12R1.113 C=C(C)c1ccc(cn1)CC#N 271570a_100000694244_100000703598 [0,2,0,0,0,0|2,0,0]=4 5138 B12R1.113 C=C(C)c1ccc(cn1)CCO 271570a_100000694244_100009880866 [0,2,0,0,0,0|2,0,0]=4 5139 B12R1.113 C=C(C)c1ccc(cn1)CNC 271570a_100000694244_100000026953 [0,2,0,0,0,0|2,0,0]=4 5140 B12R1.113 C=C(C)c1ccc(cn1)CNN 271570a_100000694244_106726394036 [0,2,0,0,0,0|2,0,0]=4 5141 B12R1.113 C=C(C)c1ccc(cn1)CSC 271570a_100000694244_100000753673 [0,2,0,0,0,0|2,0,0]=4 5142 B12R1.113 C=C(C)c1ccc(cn1)OCC 271570a_100000694244_100000753957 [0,2,0,0,0,0|2,0,0]=4 5143 B12R1.113 C=C(C)c1ccc(nc1)CC#N 271570a_100000694244_100011824422 [0,2,0,0,0,0|2,0,0]=4 5144 B12R1.113 C=C(C)c1ccc(nc1)CCO 271570a_100000694244_100012357577 [0,2,0,0,0,0|2,0,0]=4 5145 B12R1.113 C=C(C)c1ccc(nc1)NCC 271570a_100000694244_100000741496 [0,2,0,0,0,0|2,0,0]=4 5146 B12R1.113 C=C(C)c1ccc(nc1)OCC 271570a_100000694244_100011219444 [0,2,0,0,0,0|2,0,0]=4 5147 B12R1.113 C=C(C)c1ccc(nc1)SCC 271570a_100000694244_100000690189 [0,2,0,0,0,0|2,0,0]=4 5148 B12R1.113 C=C=Cc1ccc(cc1)C(=C)C 271570a_100015277604_100000185454 [0,2,0,0,0,0|1,0,1]=4 5149 B12R1.113 C=C=Cc1ccc(cc1)C(=O)C 271570a_100015277604_100000185465 [0,2,0,0,0,0|0,0,1]=3 5150 B12R1.113 C=C=Cc1ccc(cc1)C(=O)N 271570a_100015277604_100000162191 [0,2,0,0,0,0|1,0,1]=4 5151 B12R1.113 C=C=Cc1ccc(cc1)S(=O)C 271570a_100015277604_100009816266 [0,2,0,0,0,0|1,0,1]=4 5152 B12R1.113 C=C=Cc1ccc(cn1)C(=O)C 271570a_100015277604_100000684857 [0,2,0,0,0,0|1,0,1]=4 5153 B12R1.113 C=C=Cc1ccc(nc1)C(=O)C 271570a_100015277604_100000686046 [0,2,0,0,0,0|1,0,1]=4 5154 B12R1.113 CC#Cc1ccc(cc1)C(=O)C 1458a_100009923575_200000210301 [0,2,0,0,0,0|0,0,0]=2 5155 B12R1.113 CC#Cc1ccc(cc1)C(=O)[13CH3] 1458a_100009923575_200025704644 [0,2,0,0,0,0|0,0,0]=2 5156 B12R1.113 CC(=O)c1ccc(cc1)CC#N 1458a_100000693995_200000210301 [0,2,0,0,0,0|0,0,0]=2 5157 B12R1.113 CC(=O)c1ccc(cc1)CCO 1458a_100000078963_200000210301 [0,2,0,0,0,0|0,0,0]=2 5158 B12R1.113 CC(=O)c1ccc(cc1)CO[13CH3] 7a_100000082505_200025704644 [0,2,0,0,0,0|0,0,0]=2 5159 B12R1.113 CC(=O)c1ccc(cc1)CS[13CH3] 62a_100000756337_200025704644 [0,2,0,0,0,0|0,0,0]=2 5160 B12R1.113 CC(=O)c1ccc(cc1)CS[13CH3] 62a_200025704644_100000756337 [0,2,0,0,0,0|0,0,0]=2 5161 B12R1.113 CC(=O)c1ccc(cc1)N=[N+]=[N-] 1458a_100000039380_200000210301 [0,2,0,0,0,0|1,0,0]=3 5162 B12R1.113 CC(=O)c1ccc(cc1)OCF 34a_100000185113_100015361967 [0,2,0,0,0,0|0,0,0]=2 5163 B12R1.113 CC(=O)c1ccc(cc1)OCF 7a_100000185113_100015361967 [0,2,0,0,0,0|0,0,0]=2 5164 B12R1.113 CC(=O)c1ccc(cc1)SCF 62a_100000185465_100015361967 [0,2,0,0,0,0|0,0,0]=2 5165 B12R1.113 CC(=O)c1ccc(cc1)SCF 62a_100015361967_100000185465 [0,2,0,0,0,0|0,0,0]=2 5166 B12R1.113 CC(=O)c1ccc(cn1)OCF 34a_100012001710_100015361967 [0,2,0,0,0,0|1,0,0]=3 5167 B12R1.113 CC(=O)c1ccc(cn1)OCF 7a_100012001710_100015361967 [0,2,0,0,0,0|1,0,0]=3 5168 B12R1.113 CC(=O)c1ccc(cn1)SCF 62a_100000686046_100015361967 [0,2,0,0,0,0|1,0,0]=3 5169 B12R1.113 CC(=O)c1ccc(cn1)SCF 62a_100015361967_100000686046 [0,2,0,0,0,0|1,0,0]=3 5170 B12R1.113 CC(=O)c1ccc(nc1)SCF 62a_100000684857_100015361967 [0,2,0,0,0,0|1,0,0]=3 5171 B12R1.113 CC(=O)c1ccc(nc1)SCF 62a_100015361967_100000684857 [0,2,0,0,0,0|1,0,0]=3 5172 B12R1.113 CC(=O)c1cnc(cn1)SCF 62a_100009883172_100015361967 [0,2,0,0,0,0|2,0,0]=4 5173 B12R1.113 CC(=O)c1cnc(cn1)SCF 62a_100015361967_100009883172 [0,2,0,0,0,0|2,0,0]=4 5174 B12R1.113 CC(=O)c1cnc(nc1)SCF 62a_100000099681_100015361967 [0,2,0,0,0,0|2,0,0]=4 5175 B12R1.113 CC(=O)c1cnc(nc1)SCF 62a_100015361967_100000099681 [0,2,0,0,0,0|2,0,0]=4 5176 B12R1.113 CC(=O)c1ncc(cn1)SCF 62a_100010077182_100015361967 [0,2,0,0,0,0|2,0,0]=4 5177 B12R1.113 CC(=O)c1ncc(cn1)SCF 62a_100015361967_100010077182 [0,2,0,0,0,0|2,0,0]=4 5178 B12R1.113 CC(C)c1ccc(cc1)CN[13CH3] 2230a_100000174979_200025704644 [0,2,0,0,0,0|1,0,1]=4 5179 B12R1.113 CC(C)c1ccc(cc1)CN[13CH3] 34a_100000174979_200025704644 [0,2,0,0,0,0|1,0,1]=4 5180 B12R1.113 CC(C)c1ccc(cc1)CO[13CH3] 34a_100000181325_200025704644 [0,2,0,0,0,0|1,0,1]=4 5181 B12R1.113 CC(C)c1ccc(cc1)CO[13CH3] 7a_100000181325_200025704644 [0,2,0,0,0,0|1,0,1]=4 5182 B12R1.113 CC(C)c1ccc(cc1)CS[13CH3] 62a_100000181262_200025704644 [0,2,0,0,0,0|1,0,1]=4 5183 B12R1.113 CC(C)c1ccc(cc1)CS[13CH3] 62a_200025704644_100000181262 [0,2,0,0,0,0|1,0,1]=4 5184 B12R1.113 CC(C)c1ccc(cc1)NCF 34a_100000210773_100015361967 [0,2,0,0,0,0|1,0,1]=4 5185 B12R1.113 CC(C)c1ccc(cc1)NCF 7a_100000210773_100015361967 [0,2,0,0,0,0|1,0,1]=4 5186 B12R1.113 CC(C)c1ccc(cc1)OCF 34a_100000181308_100015361967 [0,2,0,0,0,0|1,0,1]=4 5187 B12R1.113 CC(C)c1ccc(cc1)OCF 7a_100000181308_100015361967 [0,2,0,0,0,0|1,0,1]=4 5188 B12R1.113 CC(C)c1ccc(cc1)SCF 62a_100000750031_100015361967 [0,2,0,0,0,0|1,0,1]=4 5189 B12R1.113 CC(C)c1ccc(cc1)SCF 62a_100015361967_100000750031 [0,2,0,0,0,0|1,0,1]=4 5190 B12R1.113 CC(O)c1ccc(cc1)CN[13CH3] 2230a_200000048501_200025704644 [0,2,0,0,0,0|0,0,2]=4 5191 B12R1.113 CC(O)c1ccc(cc1)CN[13CH3] 34a_200000048501_200025704644 [0,2,0,0,0,0|0,0,2]=4 5192 B12R1.113 CC(O)c1ccc(cc1)NCF 34a_100011216399_100015361967 [0,2,0,0,0,0|0,0,2]=4 5193 B12R1.113 CC(O)c1ccc(cc1)OCF 34a_100000754508_100015361967 [0,2,0,0,0,0|0,0,2]=4 5194 B12R1.113 CC(O)c1ccc(cc1)OCF 7a_100000754508_100015361967 [0,2,0,0,0,0|0,0,2]=4 5195 B12R1.113 CC(O)c1ccc(cc1)SCF 62a_100000745893_100015361967 [0,2,0,0,0,0|0,0,2]=4 5196 B12R1.113 CC(O)c1ccc(cc1)SCF 62a_100015361967_100000745893 [0,2,0,0,0,0|0,0,2]=4 5197 B12R1.113 CC=Cc1ccc(cc1)C(=O)C 271570a_100016259895_100000185465 [0,2,0,0,0,0|0,0,0]=2 5198 B12R1.113 CC=Cc1ccc(cc1)C(=O)N 271570a_100016259895_100000162191 [0,2,0,0,0,0|1,0,0]=3 5199 B12R1.113 CC=Cc1ccc(cc1)C(C)C 271570a_100016259895_100000750031 [0,2,0,0,0,0|1,0,1]=4 5200 B12R1.113 CC=Cc1ccc(cc1)C(C)O 271570a_100016259895_100000745893 [0,2,0,0,0,0|0,0,2]=4 5201 B12R1.113 CC=Cc1ccc(cc1)N(C)C 271570a_100016259895_100000210421 [0,2,0,0,0,0|2,0,0]=4 5202 B12R1.113 CC=Cc1ccc(cc1)S(=O)C 271570a_100016259895_100009816266 [0,2,0,0,0,0|1,0,0]=3 5203 B12R1.113 CC=Cc1ccc(cc1)[C@@H](C)N 271570a_100016259895_100000720352 [0,2,0,0,0,0|1,0,1]=4 5204 B12R1.113 CC=Cc1ccc(cc1)[C@H](C)N 271570a_100016259895_100000753911 [0,2,0,0,0,0|1,0,1]=4 5205 B12R1.113 CC=Cc1ccc(cn1)C(=O)C 271570a_100016259895_100000684857 [0,2,0,0,0,0|1,0,0]=3 5206 B12R1.113 CC=Cc1ccc(cn1)C(=O)N 271570a_100016259895_100000162237 [0,2,0,0,0,0|2,0,0]=4 5207 B12R1.113 CC=Cc1ccc(nc1)C(=O)C 271570a_100016259895_100000686046 [0,2,0,0,0,0|1,0,0]=3 5208 B12R1.113 CC=Cc1ccc(nc1)C(=O)N 271570a_100016259895_100011219284 [0,2,0,0,0,0|2,0,0]=4 5209 B12R1.113 CC=Cc1cnc(cn1)C(=O)C 271570a_100016259895_100009883172 [0,2,0,0,0,0|2,0,0]=4 5210 B12R1.113 CC=Cc1cnc(nc1)C(=O)C 271570a_100016259895_100010077182 [0,2,0,0,0,0|2,0,0]=4 5211 B12R1.113 CC=Cc1ncc(cn1)C(=O)C 271570a_100016259895_100000099681 [0,2,0,0,0,0|2,0,0]=4 5212 B12R1.113 CCCc1ccc(cc1)C(=O)C 1458a_100011207308_200000210301 [0,2,0,0,0,0|0,0,0]=2 5213 B12R1.113 CCCc1ccc(cc1)C(=O)[13CH3] 1458a_100011207308_200025704644 [0,2,0,0,0,0|0,0,0]=2 5214 B12R1.113 CCNc1ccc(cc1)C(=O)N 27a_100015525214_100000162191 [0,2,0,0,0,0|1,0,0]=3 5215 B12R1.113 CCNc1ccc(cc1)C(=O)N 34a_100000210537_100000210202 [0,2,0,0,0,0|1,0,0]=3 5216 B12R1.113 CCNc1ccc(cc1)C(C)C 2230a_100000210773_100000210202 [0,2,0,0,0,0|1,0,1]=4 5217 B12R1.113 CCNc1ccc(cc1)C(C)C 34a_100000210773_100000210202 [0,2,0,0,0,0|1,0,1]=4 5218 B12R1.113 CCNc1ccc(cc1)C(C)C 7a_100000210773_100000210202 [0,2,0,0,0,0|1,0,1]=4 5219 B12R1.113 CCNc1ccc(cc1)C(C)O 2230a_100011216399_100000210202 [0,2,0,0,0,0|0,0,2]=4 5220 B12R1.113 CCNc1ccc(cc1)C(C)O 34a_100011216399_100000210202 [0,2,0,0,0,0|0,0,2]=4 5221 B12R1.113 CCNc1ccc(cc1)N(C)C 34a_100016997997_100000210202 [0,2,0,0,0,0|2,0,0]=4 5222 B12R1.113 CCNc1ccc(cc1)[N+](=O)[O-] 2230a_100015195142_100000210202 [0,2,0,0,0,0|2,0,0]=4 5223 B12R1.113 CCNc1ccc(cc1)[N+](=O)[O-] 34a_100015195142_100000210202 [0,2,0,0,0,0|2,0,0]=4 5224 B12R1.113 CCNc1ccc(cn1)C(=O)C 27a_100015525214_100000690552 [0,2,0,0,0,0|1,0,0]=3 5225 B12R1.113 CCNc1ccc(cn1)C(=O)N 27a_100015525214_100000162237 [0,2,0,0,0,0|2,0,0]=4 5226 B12R1.113 CCNc1cnc(cn1)C(=O)C 27a_100015525214_100009883172 [0,2,0,0,0,0|2,0,0]=4 5227 B12R1.113 CCNc1ncc(cn1)C(=O)C 27a_100015525214_100000099681 [0,2,0,0,0,0|2,0,0]=4 5228 B12R1.113 CCOc1ccc(cc1)C(=O)C 1458a_100000181891_200000210301 [0,2,0,0,0,0|0,0,0]=2 5229 B12R1.113 CCOc1ccc(cc1)C(=O)C 34a_100000185113_100000210202 [0,2,0,0,0,0|0,0,0]=2 5230 B12R1.113 CCOc1ccc(cc1)C(=O)C 7a_100000185113_100000210202 [0,2,0,0,0,0|0,0,0]=2 5231 B12R1.113 CCOc1ccc(cc1)C(=O)N 34a_100000746352_100000210202 [0,2,0,0,0,0|1,0,0]=3 5232 B12R1.113 CCOc1ccc(cc1)C(=O)N 7a_100000746352_100000210202 [0,2,0,0,0,0|1,0,0]=3 5233 B12R1.113 CCOc1ccc(cc1)C(=O)[13CH3] 1458a_100000181891_200025704644 [0,2,0,0,0,0|0,0,0]=2 5234 B12R1.113 CCOc1ccc(cc1)C(C)C 34a_100000181308_100000210202 [0,2,0,0,0,0|1,0,1]=4 5235 B12R1.113 CCOc1ccc(cc1)C(C)C 7a_100000181308_100000210202 [0,2,0,0,0,0|1,0,1]=4 5236 B12R1.113 CCOc1ccc(cc1)C(C)O 34a_100000754508_100000210202 [0,2,0,0,0,0|0,0,2]=4 5237 B12R1.113 CCOc1ccc(cc1)C(C)O 7a_100000754508_100000210202 [0,2,0,0,0,0|0,0,2]=4 5238 B12R1.113 CCOc1ccc(cc1)N(C)C 2230a_100025784348_200000210301 [0,2,0,0,0,0|2,0,0]=4 5239 B12R1.113 CCOc1ccc(cc1)N(C)C 269982a_100025784348_200000210301 [0,2,0,0,0,0|2,0,0]=4 5240 B12R1.113 CCOc1ccc(cc1)N(C)C 34a_100000718910_100000210202 [0,2,0,0,0,0|2,0,0]=4 5241 B12R1.113 CCOc1ccc(cc1)N(C)C 34a_100025784348_200000210301 [0,2,0,0,0,0|2,0,0]=4 5242 B12R1.113 CCOc1ccc(cc1)N(C)[13CH3] 2230a_100025784348_200025704644 [0,2,0,0,0,0|2,0,0]=4 5243 B12R1.113 CCOc1ccc(cc1)N(C)[13CH3] 269982a_100025784348_200025704644 [0,2,0,0,0,0|2,0,0]=4 5244 B12R1.113 CCOc1ccc(cc1)N(C)[13CH3] 34a_100025784348_200025704644 [0,2,0,0,0,0|2,0,0]=4 5245 B12R1.113 CCOc1ccc(cc1)S(=O)C 34a_200000064373_100000210202 [0,2,0,0,0,0|1,0,0]=3 5246 B12R1.113 CCOc1ccc(cc1)S(=O)C 7a_200000064373_100000210202 [0,2,0,0,0,0|1,0,0]=3 5247 B12R1.113 CCOc1ccc(cc1)[C@H](C)N 34a_100161106496_100000210202 [0,2,0,0,0,0|1,0,1]=4 5248 B12R1.113 CCOc1ccc(cc1)[N+](=O)[O-] 34a_100000185810_100000210202 [0,2,0,0,0,0|2,0,0]=4 5249 B12R1.113 CCOc1ccc(cc1)[N+](=O)[O-] 7a_100000185810_100000210202 [0,2,0,0,0,0|2,0,0]=4 5250 B12R1.113 CCOc1ccc(cc1)[S+](C)C 34a_100010188728_100000210202 [0,2,0,0,0,0|2,0,0]=4 5251 B12R1.113 CCOc1ccc(cc1)[S+](C)C 7a_100010188728_100000210202 [0,2,0,0,0,0|2,0,0]=4 5252 B12R1.113 CCOc1ccc(nc1)C(=O)C 34a_100012001710_100000210202 [0,2,0,0,0,0|1,0,0]=3 5253 B12R1.113 CCOc1ccc(nc1)C(=O)C 7a_100012001710_100000210202 [0,2,0,0,0,0|1,0,0]=3 5254 B12R1.113 CCSc1ccc(cc1)C(=O)C 1458a_100000244969_200000210301 [0,2,0,0,0,0|0,0,0]=2 5255 B12R1.113 CCSc1ccc(cc1)C(=O)C 62a_100000185465_100000210202 [0,2,0,0,0,0|0,0,0]=2 5256 B12R1.113 CCSc1ccc(cc1)C(=O)C 62a_100000210202_100000185465 [0,2,0,0,0,0|0,0,0]=2 5257 B12R1.113 CCSc1ccc(cc1)C(=O)N 62a_100000162191_100000210202 [0,2,0,0,0,0|1,0,0]=3 5258 B12R1.113 CCSc1ccc(cc1)C(=O)N 62a_100000210202_100000162191 [0,2,0,0,0,0|1,0,0]=3 5259 B12R1.113 CCSc1ccc(cc1)C(=O)[13CH3] 1458a_100000244969_200025704644 [0,2,0,0,0,0|0,0,0]=2 5260 B12R1.113 CCSc1ccc(cc1)C(C)C 62a_100000210202_100000750031 [0,2,0,0,0,0|1,0,1]=4 5261 B12R1.113 CCSc1ccc(cc1)C(C)C 62a_100000750031_100000210202 [0,2,0,0,0,0|1,0,1]=4 5262 B12R1.113 CCSc1ccc(cc1)C(C)O 62a_100000210202_100000745893 [0,2,0,0,0,0|0,0,2]=4 5263 B12R1.113 CCSc1ccc(cc1)C(C)O 62a_100000745893_100000210202 [0,2,0,0,0,0|0,0,2]=4 5264 B12R1.113 CCSc1ccc(cc1)N(C)C 62a_100000210202_100000210421 [0,2,0,0,0,0|2,0,0]=4 5265 B12R1.113 CCSc1ccc(cc1)N(C)C 62a_100000210421_100000210202 [0,2,0,0,0,0|2,0,0]=4 5266 B12R1.113 CCSc1ccc(cc1)S(=O)C 62a_100009816266_100000210202 [0,2,0,0,0,0|1,0,0]=3 5267 B12R1.113 CCSc1ccc(cc1)[C@@H](C)N 62a_100000210202_100000720352 [0,2,0,0,0,0|1,0,1]=4 5268 B12R1.113 CCSc1ccc(cc1)[C@@H](C)N 62a_100000720352_100000210202 [0,2,0,0,0,0|1,0,1]=4 5269 B12R1.113 CCSc1ccc(cc1)[C@H](C)N 62a_100000210202_100000753911 [0,2,0,0,0,0|1,0,1]=4 5270 B12R1.113 CCSc1ccc(cc1)[C@H](C)N 62a_100000753911_100000210202 [0,2,0,0,0,0|1,0,1]=4 5271 B12R1.113 CCSc1ccc(cn1)C(=O)C 62a_100000210202_100000684857 [0,2,0,0,0,0|1,0,0]=3 5272 B12R1.113 CCSc1ccc(cn1)C(=O)C 62a_100000684857_100000210202 [0,2,0,0,0,0|1,0,0]=3 5273 B12R1.113 CCSc1ccc(cn1)C(=O)N 62a_100000162237_100000210202 [0,2,0,0,0,0|2,0,0]=4 5274 B12R1.113 CCSc1ccc(cn1)C(=O)N 62a_100000210202_100000162237 [0,2,0,0,0,0|2,0,0]=4 5275 B12R1.113 CCSc1ccc(nc1)C(=O)C 62a_100000210202_100000686046 [0,2,0,0,0,0|1,0,0]=3 5276 B12R1.113 CCSc1ccc(nc1)C(=O)C 62a_100000686046_100000210202 [0,2,0,0,0,0|1,0,0]=3 5277 B12R1.113 CCSc1ccc(nc1)C(=O)N 62a_100000210202_100011219284 [0,2,0,0,0,0|2,0,0]=4 5278 B12R1.113 CCSc1ccc(nc1)C(=O)N 62a_100011219284_100000210202 [0,2,0,0,0,0|2,0,0]=4 5279 B12R1.113 CCSc1cnc(cn1)C(=O)C 62a_100000210202_100009883172 [0,2,0,0,0,0|2,0,0]=4 5280 B12R1.113 CCSc1cnc(cn1)C(=O)C 62a_100009883172_100000210202 [0,2,0,0,0,0|2,0,0]=4 5281 B12R1.113 CCSc1cnc(nc1)C(=O)C 62a_100000210202_100010077182 [0,2,0,0,0,0|2,0,0]=4 5282 B12R1.113 CCSc1cnc(nc1)C(=O)C 62a_100010077182_100000210202 [0,2,0,0,0,0|2,0,0]=4 5283 B12R1.113 CCSc1ncc(cn1)C(=O)C 62a_100000099681_100000210202 [0,2,0,0,0,0|2,0,0]=4 5284 B12R1.113 CCSc1ncc(cn1)C(=O)C 62a_100000210202_100000099681 [0,2,0,0,0,0|2,0,0]=4 5285 B12R1.113 CN(C)c1ccc(cc1)CO[13CH3] 34a_100000238745_200025704644 [0,2,0,0,0,0|2,0,0]=4 5286 B12R1.113 CN(C)c1ccc(cc1)NCF 34a_100016997997_100015361967 [0,2,0,0,0,0|2,0,0]=4 5287 B12R1.113 CN(C)c1ccc(cc1)OCF 34a_100000718910_100015361967 [0,2,0,0,0,0|2,0,0]=4 5288 B12R1.113 CN(C)c1ccc(cc1)SCF 62a_100000210421_100015361967 [0,2,0,0,0,0|2,0,0]=4 5289 B12R1.113 CN(C)c1ccc(cc1)SCF 62a_100015361967_100000210421 [0,2,0,0,0,0|2,0,0]=4 5290 B12R1.113 CNCc1ccc(cc1)C(=O)C 2230a_106832991635_100000756337 [0,2,0,0,0,0|0,0,0]=2 5291 B12R1.113 CNCc1ccc(cc1)C(=O)C 26a_100102657272_100000185113 [0,2,0,0,0,0|0,0,0]=2 5292 B12R1.113 CNCc1ccc(cc1)C(=O)C 34a_100102657272_100000756337 [0,2,0,0,0,0|0,0,0]=2 5293 B12R1.113 CNCc1ccc(cc1)C(=O)C 7a_106832991635_100000756337 [0,2,0,0,0,0|0,0,0]=2 5294 B12R1.113 CNCc1ccc(cc1)C(=O)N 207a_100102657272_100000038677 [0,2,0,0,0,0|1,0,0]=3 5295 B12R1.113 CNCc1ccc(cc1)C(=O)N 2230a_106832991635_100000231043 [0,2,0,0,0,0|1,0,0]=3 5296 B12R1.113 CNCc1ccc(cc1)C(=O)N 270004a_106832991635_100000038677 [0,2,0,0,0,0|1,0,0]=3 5297 B12R1.113 CNCc1ccc(cc1)C(=O)N 34a_100102657272_100000231043 [0,2,0,0,0,0|1,0,0]=3 5298 B12R1.113 CNCc1ccc(cc1)C(=O)N 7a_106832991635_100000231043 [0,2,0,0,0,0|1,0,0]=3 5299 B12R1.113 CNCc1ccc(cc1)C(=O)O 269956a_100000181780_200000210301 [0,2,0,0,0,0|1,0,0]=3 5300 B12R1.113 CNCc1ccc(cc1)C(=O)[O-] 26a_100102657272_100016998105 [0,2,0,0,0,0|1,0,0]=3 5301 B12R1.113 CNCc1ccc(cc1)C(C)C 207a_100102657272_100000210693 [0,2,0,0,0,0|1,0,1]=4 5302 B12R1.113 CNCc1ccc(cc1)C(C)C 2230a_100000174979_200000210301 [0,2,0,0,0,0|1,0,1]=4 5303 B12R1.113 CNCc1ccc(cc1)C(C)C 2230a_106832991635_100000181262 [0,2,0,0,0,0|1,0,1]=4 5304 B12R1.113 CNCc1ccc(cc1)C(C)C 26a_100102657272_100000181308 [0,2,0,0,0,0|1,0,1]=4 5305 B12R1.113 CNCc1ccc(cc1)C(C)C 270004a_106832991635_100000210693 [0,2,0,0,0,0|1,0,1]=4 5306 B12R1.113 CNCc1ccc(cc1)C(C)C 34a_100000174979_200000210301 [0,2,0,0,0,0|1,0,1]=4 5307 B12R1.113 CNCc1ccc(cc1)C(C)C 34a_100102657272_100000181262 [0,2,0,0,0,0|1,0,1]=4 5308 B12R1.113 CNCc1ccc(cc1)C(C)C 7a_106832991635_100000181262 [0,2,0,0,0,0|1,0,1]=4 5309 B12R1.113 CNCc1ccc(cc1)C(C)O 2230a_200000048501_200000210301 [0,2,0,0,0,0|0,0,2]=4 5310 B12R1.113 CNCc1ccc(cc1)C(C)O 26a_100102657272_100000754508 [0,2,0,0,0,0|0,0,2]=4 5311 B12R1.113 CNCc1ccc(cc1)C(C)O 34a_200000048501_200000210301 [0,2,0,0,0,0|0,0,2]=4 5312 B12R1.113 CNCc1ccc(cc1)N(C)C 207a_100102657272_100000185837 [0,2,0,0,0,0|2,0,0]=4 5313 B12R1.113 CNCc1ccc(cc1)N(C)C 270004a_106832991635_100000185837 [0,2,0,0,0,0|2,0,0]=4 5314 B12R1.113 CNCc1ccc(cc1)S(=O)C 26a_100102657272_200000064373 [0,2,0,0,0,0|1,0,0]=3 5315 B12R1.113 CNCc1ccc(cc1)[N+](=O)[O-] 207a_100102657272_100000189386 [0,2,0,0,0,0|2,0,0]=4 5316 B12R1.113 CNCc1ccc(cc1)[N+](=O)[O-] 2230a_100000742766_200000210301 [0,2,0,0,0,0|2,0,0]=4 5317 B12R1.113 CNCc1ccc(cc1)[N+](=O)[O-] 2230a_106832991635_100000181861 [0,2,0,0,0,0|2,0,0]=4 5318 B12R1.113 CNCc1ccc(cc1)[N+](=O)[O-] 26a_100102657272_100000185810 [0,2,0,0,0,0|2,0,0]=4 5319 B12R1.113 CNCc1ccc(cc1)[N+](=O)[O-] 270004a_106832991635_100000189386 [0,2,0,0,0,0|2,0,0]=4 5320 B12R1.113 CNCc1ccc(cc1)[N+](=O)[O-] 34a_100000742766_200000210301 [0,2,0,0,0,0|2,0,0]=4 5321 B12R1.113 CNCc1ccc(cc1)[N+](=O)[O-] 34a_100102657272_100000181861 [0,2,0,0,0,0|2,0,0]=4 5322 B12R1.113 CNCc1ccc(cc1)[N+](=O)[O-] 7a_106832991635_100000181861 [0,2,0,0,0,0|2,0,0]=4 5323 B12R1.113 CNCc1ccc(cc1)[S+](C)C 26a_100102657272_100010188728 [0,2,0,0,0,0|2,0,0]=4 5324 B12R1.113 CNCc1ccc(nc1)C(=O)O 269956a_100000762669_200000210301 [0,2,0,0,0,0|2,0,0]=4 5325 B12R1.113 COCc1ccc(cc1)C(=O)C 1458a_100000189608_200000210301 [0,2,0,0,0,0|0,0,0]=2 5326 B12R1.113 COCc1ccc(cc1)C(=O)C 34a_100138415774_100000756337 [0,2,0,0,0,0|0,0,0]=2 5327 B12R1.113 COCc1ccc(cc1)C(=O)C 7a_100000082505_200000210301 [0,2,0,0,0,0|0,0,0]=2 5328 B12R1.113 COCc1ccc(cc1)C(=O)N 34a_100000162016_200000210301 [0,2,0,0,0,0|1,0,0]=3 5329 B12R1.113 COCc1ccc(cc1)C(=O)N 34a_100138415774_100000231043 [0,2,0,0,0,0|1,0,0]=3 5330 B12R1.113 COCc1ccc(cc1)C(=O)N 7a_100000162016_200000210301 [0,2,0,0,0,0|1,0,0]=3 5331 B12R1.113 COCc1ccc(cc1)C(=O)[13CH3] 1458a_100000189608_200025704644 [0,2,0,0,0,0|0,0,0]=2 5332 B12R1.113 COCc1ccc(cc1)C(C)C 34a_100000181325_200000210301 [0,2,0,0,0,0|1,0,1]=4 5333 B12R1.113 COCc1ccc(cc1)C(C)C 34a_100138415774_100000181262 [0,2,0,0,0,0|1,0,1]=4 5334 B12R1.113 COCc1ccc(cc1)C(C)C 7a_100000181325_200000210301 [0,2,0,0,0,0|1,0,1]=4 5335 B12R1.113 COCc1ccc(cc1)N(C)C 34a_100000238745_200000210301 [0,2,0,0,0,0|2,0,0]=4 5336 B12R1.113 COCc1ccc(cc1)[N+](=O)[O-] 34a_100000211695_200000210301 [0,2,0,0,0,0|2,0,0]=4 5337 B12R1.113 COCc1ccc(cc1)[N+](=O)[O-] 34a_100138415774_100000181861 [0,2,0,0,0,0|2,0,0]=4 5338 B12R1.113 CS(=O)c1ccc(cc1)OCF 34a_200000064373_100015361967 [0,2,0,0,0,0|1,0,0]=3 5339 B12R1.113 CS(=O)c1ccc(cc1)OCF 7a_200000064373_100015361967 [0,2,0,0,0,0|1,0,0]=3 5340 B12R1.113 CS(=O)c1ccc(cc1)SCF 62a_100009816266_100015361967 [0,2,0,0,0,0|1,0,0]=3 5341 B12R1.113 CSCc1ccc(cc1)C(=O)C 1458a_100000175442_200000210301 [0,2,0,0,0,0|0,0,0]=2 5342 B12R1.113 CSCc1ccc(cc1)C(=O)C 62a_100000756337_200000210301 [0,2,0,0,0,0|0,0,0]=2 5343 B12R1.113 CSCc1ccc(cc1)C(=O)C 62a_200000210301_100000756337 [0,2,0,0,0,0|0,0,0]=2 5344 B12R1.113 CSCc1ccc(cc1)C(=O)N 62a_100000231043_200000210301 [0,2,0,0,0,0|1,0,0]=3 5345 B12R1.113 CSCc1ccc(cc1)C(=O)N 62a_200000210301_100000231043 [0,2,0,0,0,0|1,0,0]=3 5346 B12R1.113 CSCc1ccc(cc1)C(=O)[13CH3] 1458a_100000175442_200025704644 [0,2,0,0,0,0|0,0,0]=2 5347 B12R1.113 CSCc1ccc(cc1)C(C)C 62a_100000181262_200000210301 [0,2,0,0,0,0|1,0,1]=4 5348 B12R1.113 CSCc1ccc(cc1)C(C)C 62a_200000210301_100000181262 [0,2,0,0,0,0|1,0,1]=4 5349 B12R1.113 CSCc1ccc(cc1)[N+](=O)[O-] 62a_200000210301_100000184243 [0,2,0,0,0,0|2,0,0]=4 5350 B12R1.113 C[C@@H](N)c1ccc(cc1)SCF 62a_100000720352_100015361967 [0,2,0,0,0,0|1,0,1]=4 5351 B12R1.113 C[C@@H](N)c1ccc(cc1)SCF 62a_100015361967_100000720352 [0,2,0,0,0,0|1,0,1]=4 5352 B12R1.113 C[C@H](N)c1ccc(cc1)OCF 34a_100161106496_100015361967 [0,2,0,0,0,0|1,0,1]=4 5353 B12R1.113 C[C@H](N)c1ccc(cc1)SCF 62a_100000753911_100015361967 [0,2,0,0,0,0|1,0,1]=4 5354 B12R1.113 C[C@H](N)c1ccc(cc1)SCF 62a_100015361967_100000753911 [0,2,0,0,0,0|1,0,1]=4 5355 B12R1.113 C[S+](C)c1ccc(cc1)OCF 34a_100010188728_100015361967 [0,2,0,0,0,0|2,0,0]=4 5356 B12R1.113 C[S+](C)c1ccc(cc1)OCF 7a_100010188728_100015361967 [0,2,0,0,0,0|2,0,0]=4 5357 B12R1.113 NC(=O)c1ccc(cc1)NCF 34a_100000210537_100015361967 [0,2,0,0,0,0|1,0,0]=3 5358 B12R1.113 NC(=O)c1ccc(cc1)OCF 34a_100000746352_100015361967 [0,2,0,0,0,0|1,0,0]=3 5359 B12R1.113 NC(=O)c1ccc(cc1)OCF 7a_100000746352_100015361967 [0,2,0,0,0,0|1,0,0]=3 5360 B12R1.113 NC(=O)c1ccc(cc1)SCF 62a_100000162191_100015361967 [0,2,0,0,0,0|1,0,0]=3 5361 B12R1.113 NC(=O)c1ccc(cc1)SCF 62a_100015361967_100000162191 [0,2,0,0,0,0|1,0,0]=3 5362 B12R1.113 NC(=O)c1ccc(cn1)SCF 62a_100011219284_100015361967 [0,2,0,0,0,0|2,0,0]=4 5363 B12R1.113 NC(=O)c1ccc(cn1)SCF 62a_100015361967_100011219284 [0,2,0,0,0,0|2,0,0]=4 5364 B12R1.113 NC(=O)c1ccc(nc1)SCF 62a_100000162237_100015361967 [0,2,0,0,0,0|2,0,0]=4 5365 B12R1.113 NC(=O)c1ccc(nc1)SCF 62a_100015361967_100000162237 [0,2,0,0,0,0|2,0,0]=4 5366 B12R1.113 O=[N+]([O-])c1ccc(cc1)NCF 34a_100015195142_100015361967 [0,2,0,0,0,0|2,0,0]=4 5367 B12R1.113 O=[N+]([O-])c1ccc(cc1)OCF 34a_100000185810_100015361967 [0,2,0,0,0,0|2,0,0]=4 5368 B12R1.113 O=[N+]([O-])c1ccc(cc1)OCF 7a_100000185810_100015361967 [0,2,0,0,0,0|2,0,0]=4 5369 B12R1.113 [13CH3]C(=O)c1ccc(cc1)CC#N 1458a_100000693995_200025704644 [0,2,0,0,0,0|0,0,0]=2 5370 B12R1.113 [13CH3]C(=O)c1ccc(cc1)CCO 1458a_100000078963_200025704644 [0,2,0,0,0,0|0,0,0]=2 5371 B12R1.113 [13CH3]C(=O)c1ccc(cc1)N=[N+]=[N-] 1458a_100000039380_200025704644 [0,2,0,0,0,0|1,0,0]=3 5372 B12R1.113 [13CH3]NCc1ccc(cc1)C(=O)O 269956a_100000181780_200025704644 [0,2,0,0,0,0|1,0,0]=3 5373 B12R1.113 [13CH3]NCc1ccc(cc1)[N+](=O)[O-] 2230a_100000742766_200025704644 [0,2,0,0,0,0|2,0,0]=4 5374 B12R1.113 [13CH3]NCc1ccc(cc1)[N+](=O)[O-] 34a_100000742766_200025704644 [0,2,0,0,0,0|2,0,0]=4 5375 B12R1.113 [13CH3]NCc1ccc(nc1)C(=O)O 269956a_100000762669_200025704644 [0,2,0,0,0,0|2,0,0]=4 5376 B12R1.113 [13CH3]OCc1ccc(cc1)C(=O)N 34a_100000162016_200025704644 [0,2,0,0,0,0|1,0,0]=3 5377 B12R1.113 [13CH3]OCc1ccc(cc1)C(=O)N 7a_100000162016_200025704644 [0,2,0,0,0,0|1,0,0]=3 5378 B12R1.113 [13CH3]OCc1ccc(cc1)[N+](=O)[O-] 34a_100000211695_200025704644 [0,2,0,0,0,0|2,0,0]=4 5379 B12R1.113 [13CH3]SCc1ccc(cc1)C(=O)N 62a_100000231043_200025704644 [0,2,0,0,0,0|1,0,0]=3 5380 B12R1.113 [13CH3]SCc1ccc(cc1)C(=O)N 62a_200025704644_100000231043 [0,2,0,0,0,0|1,0,0]=3 5381 B12R1.113 [13CH3]SCc1ccc(cc1)[N+](=O)[O-] 62a_200025704644_100000184243 [0,2,0,0,0,0|2,0,0]=4 5382 B12R1.256 C=C(C)c1ccc(cc1)B(O)O 271570a_100000694244_100000754493 [0,2,0,0,0,0|2,0,0]=4 5383 B12R1.256 C=C(C)c1ccc(cc1)C(=C)C 271570a_100000694244_100000185454 [0,2,0,0,0,0|1,0,0]=3 5384 B12R1.256 C=C(C)c1ccc(cc1)C(=O)C 1458a_200009908186_200000210301 [0,2,0,0,0,0|0,0,0]=2 5385 B12R1.256 C=C(C)c1ccc(cc1)C(=O)C 271570a_100000694244_100000185465 [0,2,0,0,0,0|0,0,0]=2 5386 B12R1.256 C=C(C)c1ccc(cc1)C(=O)N 271570a_100000694244_100000162191 [0,2,0,0,0,0|1,0,0]=3 5387 B12R1.256 C=C(C)c1ccc(cc1)C(=O)[13CH3] 1458a_200009908186_200025704644 [0,2,0,0,0,0|0,0,0]=2 5388 B12R1.256 C=C(C)c1ccc(cc1)C(C)C 271570a_100000694244_100000750031 [0,2,0,0,0,0|1,0,0]=3 5389 B12R1.256 C=C(C)c1ccc(cc1)C(C)O 271570a_100000694244_100000745893 [0,2,0,0,0,0|1,0,0]=3 5390 B12R1.256 C=C(C)c1ccc(cc1)C(F)F 271570a_100000694244_100010189923 [0,2,0,0,0,0|1,0,0]=3 5391 B12R1.256 C=C(C)c1ccc(cc1)N(C)C 271570a_100000694244_100000210421 [0,2,0,0,0,0|1,0,0]=3 5392 B12R1.256 C=C(C)c1ccc(cc1)S(=O)C 271570a_100000694244_100009816266 [0,2,0,0,0,0|1,0,0]=3 5393 B12R1.256 C=C(C)c1ccc(cc1)[C@@H](C)N 271570a_100000694244_100000720352 [0,2,0,0,0,0|1,0,0]=3 5394 B12R1.256 C=C(C)c1ccc(cc1)[C@H](C)N 271570a_100000694244_100000753911 [0,2,0,0,0,0|1,0,0]=3 5395 B12R1.256 C=C(C)c1ccc(cn1)C(=O)C 271570a_100000694244_100000684857 [0,2,0,0,0,0|1,0,0]=3 5396 B12R1.256 C=C(C)c1ccc(cn1)C(=O)N 271570a_100000694244_100000162237 [0,2,0,0,0,0|2,0,0]=4 5397 B12R1.256 C=C(C)c1ccc(cn1)C(C)C 271570a_100000694244_200009815286 [0,2,0,0,0,0|2,0,0]=4 5398 B12R1.256 C=C(C)c1ccc(cn1)C(C)O 271570a_100000694244_200010274204 [0,2,0,0,0,0|2,0,0]=4 5399 B12R1.256 C=C(C)c1ccc(cn1)C(F)F 271570a_100000694244_100000720607 [0,2,0,0,0,0|2,0,0]=4 5400 B12R1.256 C=C(C)c1ccc(cn1)N(C)C 271570a_100000694244_100009992925 [0,2,0,0,0,0|2,0,0]=4 5401 B12R1.256 C=C(C)c1ccc(cn1)[C@H](C)N 271570a_100000694244_100015387476 [0,2,0,0,0,0|2,0,0]=4 5402 B12R1.256 C=C(C)c1ccc(nc1)C(=O)C 271570a_100000694244_100000686046 [0,2,0,0,0,0|1,0,0]=3 5403 B12R1.256 C=C(C)c1ccc(nc1)C(=O)N 271570a_100000694244_100011219284 [0,2,0,0,0,0|2,0,0]=4 5404 B12R1.256 C=C(C)c1ccc(nc1)C(C)C 271570a_100000694244_100010255768 [0,2,0,0,0,0|2,0,0]=4 5405 B12R1.256 C=C(C)c1ccc(nc1)C(C)N 271570a_100000694244_100000723930 [0,2,0,0,0,0|2,0,0]=4 5406 B12R1.256 C=C(C)c1ccc(nc1)C(C)O 271570a_100000694244_100012353650 [0,2,0,0,0,0|2,0,0]=4 5407 B12R1.256 C=C(C)c1ccc(nc1)C(F)F 271570a_100000694244_100010253924 [0,2,0,0,0,0|2,0,0]=4 5408 B12R1.256 C=C(C)c1ccc(nc1)N(C)C 271570a_100000694244_100011465347 [0,2,0,0,0,0|2,0,0]=4 5409 B12R1.256 C=C(C)c1cnc(cn1)C(=O)C 271570a_100000694244_100009883172 [0,2,0,0,0,0|2,0,0]=4 5410 B12R1.256 C=C(C)c1cnc(nc1)C(=O)C 271570a_100000694244_100010077182 [0,2,0,0,0,0|2,0,0]=4 5411 B12R1.256 C=C(C)c1ncc(cn1)C(=O)C 271570a_100000694244_100000099681 [0,2,0,0,0,0|2,0,0]=4 5412 B12R1.256 CC(=O)c1ccc(cc1)C(=O)N 1458a_100000230133_200000210301 [0,2,0,0,0,0|0,0,1]=3 5413 B12R1.256 CC(=O)c1ccc(cc1)C(C)C 1458a_100000210772_200000210301 [0,2,0,0,0,0|0,0,0]=2 5414 B12R1.256 CC(=O)c1ccc(cc1)C(C)O 1458a_100000076921_200000210301 [0,2,0,0,0,0|0,0,0]=2 5415 B12R1.256 CC(=O)c1ccc(cc1)C(F)F 1458a_100011735500_200000210301 [0,2,0,0,0,0|0,0,0]=2 5416 B12R1.256 CC(=O)c1ccc(cc1)N(C)C 1458a_100000210873_200000210301 [0,2,0,0,0,0|0,0,0]=2 5417 B12R1.256 CC(=O)c1ccc(cc1)S(=O)C 1458a_200000217594_200000210301 [0,2,0,0,0,0|0,0,0]=2 5418 B12R1.256 CC(=O)c1ccc(cc1)[N+](=O)[O-] 1458a_100000185811_200000210301 [0,2,0,0,0,0|1,0,0]=3 5419 B12R1.256 CC(=O)c1ccc(nc1)C(F)F 1458a_100009846429_200000210301 [0,2,0,0,0,0|1,0,0]=3 5420 B12R1.256 CC(=O)c1ccc(nc1)N(C)C 27a_100102631434_100000690552 [0,2,0,0,0,0|1,0,0]=3 5421 B12R1.256 CC(=O)c1cnc(cn1)C(F)F 1458a_100009910397_200000210301 [0,2,0,0,0,0|2,0,0]=4 5422 B12R1.256 CC(=O)c1cnc(cn1)N(C)C 27a_100102631434_100009883172 [0,2,0,0,0,0|2,0,0]=4 5423 B12R1.256 CC(=O)c1cnc(nc1)N(C)C 27a_100102631434_100000099681 [0,2,0,0,0,0|2,0,0]=4 5424 B12R1.256 CC(C)c1ccc(cc1)C(=O)[13CH3] 1458a_100000210772_200025704644 [0,2,0,0,0,0|0,0,0]=2 5425 B12R1.256 CC(C)c1ccc(cc1)N(C)C 2230a_100000688768_200000210301 [0,2,0,0,0,0|1,0,1]=4 5426 B12R1.256 CC(C)c1ccc(cc1)N(C)C 269982a_100000688768_200000210301 [0,2,0,0,0,0|1,0,1]=4 5427 B12R1.256 CC(C)c1ccc(cc1)N(C)C 34a_100000688768_200000210301 [0,2,0,0,0,0|1,0,1]=4 5428 B12R1.256 CC(C)c1ccc(cc1)N(C)C 38a_100000688768_200000210301 [0,2,0,0,0,0|1,0,1]=4 5429 B12R1.256 CC(C)c1ccc(cc1)N(C)[13CH3] 2230a_100000688768_200025704644 [0,2,0,0,0,0|1,0,1]=4 5430 B12R1.256 CC(C)c1ccc(cc1)N(C)[13CH3] 269982a_100000688768_200025704644 [0,2,0,0,0,0|1,0,1]=4 5431 B12R1.256 CC(C)c1ccc(cc1)N(C)[13CH3] 34a_100000688768_200025704644 [0,2,0,0,0,0|1,0,1]=4 5432 B12R1.256 CC(C)c1ccc(cc1)N(C)[13CH3] 38a_100000688768_200025704644 [0,2,0,0,0,0|1,0,1]=4 5433 B12R1.256 CC(O)c1ccc(cc1)C(=O)[13CH3] 1458a_100000076921_200025704644 [0,2,0,0,0,0|0,0,0]=2 5434 B12R1.256 CN(C)c1ccc(cc1)C(=O)N 27a_100102631434_100000162191 [0,2,0,0,0,0|1,0,0]=3 5435 B12R1.256 CN(C)c1ccc(cc1)C(=O)[13CH3] 1458a_100000210873_200025704644 [0,2,0,0,0,0|0,0,0]=2 5436 B12R1.256 CN(C)c1ccc(cc1)[N+](=O)[O-] 2230a_100000156523_200000210301 [0,2,0,0,0,0|2,0,0]=4 5437 B12R1.256 CN(C)c1ccc(cc1)[N+](=O)[O-] 269982a_100000156523_200000210301 [0,2,0,0,0,0|2,0,0]=4 5438 B12R1.256 CN(C)c1ccc(cc1)[N+](=O)[O-] 34a_100000156523_200000210301 [0,2,0,0,0,0|2,0,0]=4 5439 B12R1.256 CN(C)c1ccc(cn1)C(=O)N 27a_100102631434_100000162237 [0,2,0,0,0,0|2,0,0]=4 5440 B12R1.256 CN([13CH3])c1ccc(cc1)[N+](=O)[O-] 2230a_100000156523_200025704644 [0,2,0,0,0,0|2,0,0]=4 5441 B12R1.256 CN([13CH3])c1ccc(cc1)[N+](=O)[O-] 269982a_100000156523_200025704644 [0,2,0,0,0,0|2,0,0]=4 5442 B12R1.256 CN([13CH3])c1ccc(cc1)[N+](=O)[O-] 34a_100000156523_200025704644 [0,2,0,0,0,0|2,0,0]=4 5443 B12R1.256 CS(=O)c1ccc(cc1)C(=O)[13CH3] 1458a_200000217594_200025704644 [0,2,0,0,0,0|0,0,0]=2 5444 B12R1.256 [13CH3]C(=O)c1ccc(cc1)C(=O)N 1458a_100000230133_200025704644 [0,2,0,0,0,0|0,0,1]=3 5445 B12R1.256 [13CH3]C(=O)c1ccc(cc1)C(F)F 1458a_100011735500_200025704644 [0,2,0,0,0,0|0,0,0]=2 5446 B12R1.256 [13CH3]C(=O)c1ccc(cc1)[N+](=O)[O-] 1458a_100000185811_200025704644 [0,2,0,0,0,0|1,0,0]=3 5447 B12R1.256 [13CH3]C(=O)c1ccc(nc1)C(F)F 1458a_100009846429_200025704644 [0,2,0,0,0,0|1,0,0]=3 5448 B12R1.256 [13CH3]C(=O)c1cnc(cn1)C(F)F 1458a_100009910397_200025704644 [0,2,0,0,0,0|2,0,0]=4 5449 B12R1.452 C#Cc1ccc(c(c1)Cl)C(=O)C 1458a_100103168756_200000210301 [0,2,0,0,0,0|0,0,1]=3 5450 B12R1.452 C#Cc1ccc(c(c1)Cl)C(=O)[13CH3] 1458a_100103168756_200025704644 [0,2,0,0,0,0|0,0,1]=3 5451 B12R1.452 C=C(C)c1ccc(cc1Br)C#N 271570a_100000694244_100012356348 [0,2,0,0,0,0|1,0,1]=4 5452 B12R1.452 C=C(C)c1ccc(cc1Br)CC 271570a_100000694244_200009997437 [0,2,0,0,0,0|1,0,0]=3 5453 B12R1.452 C=C(C)c1ccc(cc1Br)OC 271570a_100000694244_100012349170 [0,2,0,0,0,0|1,0,0]=3 5454 B12R1.452 C=C(C)c1ccc(cc1C)C#N 271570a_100000694244_100000212329 [0,2,0,0,0,0|1,0,1]=4 5455 B12R1.452 C=C(C)c1ccc(cc1C)C=O 271570a_100000694244_100000765772 [0,2,0,0,0,0|1,0,1]=4 5456 B12R1.452 C=C(C)c1ccc(cc1C)CN 271570a_100000694244_100015205234 [0,2,0,0,0,0|1,0,0]=3 5457 B12R1.452 C=C(C)c1ccc(cc1C)CO 271570a_100000694244_100000718852 [0,2,0,0,0,0|1,0,0]=3 5458 B12R1.452 C=C(C)c1ccc(cc1C)NC 271570a_100000694244_100102888905 [0,2,0,0,0,0|1,0,0]=3 5459 B12R1.452 C=C(C)c1ccc(cc1C)NN 271570a_100000694244_100000745493 [0,2,0,0,0,0|2,0,0]=4 5460 B12R1.452 C=C(C)c1ccc(cc1C)OC 271570a_100000694244_100000759875 [0,2,0,0,0,0|1,0,0]=3 5461 B12R1.452 C=C(C)c1ccc(cc1Cl)C#N 271570a_100000694244_100012349663 [0,2,0,0,0,0|1,0,1]=4 5462 B12R1.452 C=C(C)c1ccc(cc1Cl)CO 271570a_100000694244_100000718186 [0,2,0,0,0,0|1,0,0]=3 5463 B12R1.452 C=C(C)c1ccc(cc1F)C#N 271570a_100000694244_100011794375 [0,2,0,0,0,0|1,0,1]=4 5464 B12R1.452 C=C(C)c1ccc(cc1F)C=O 271570a_100000694244_100000686674 [0,2,0,0,0,0|1,0,1]=4 5465 B12R1.452 C=C(C)c1ccc(cc1F)CC 271570a_100000694244_200010339503 [0,2,0,0,0,0|1,0,0]=3 5466 B12R1.452 C=C(C)c1ccc(cc1F)CN 271570a_100000694244_100000755036 [0,2,0,0,0,0|1,0,0]=3 5467 B12R1.452 C=C(C)c1ccc(cc1F)CO 271570a_100000694244_100011533735 [0,2,0,0,0,0|1,0,0]=3 5468 B12R1.452 C=C(C)c1ccc(cc1F)NC 271570a_100000694244_100012285320 [0,2,0,0,0,0|1,0,0]=3 5469 B12R1.452 C=C(C)c1ccc(cc1F)NN 271570a_100000694244_100016992936 [0,2,0,0,0,0|2,0,0]=4 5470 B12R1.452 C=C(C)c1ccc(cc1F)OC 271570a_100000694244_100000753793 [0,2,0,0,0,0|1,0,0]=3 5471 B12R1.452 C=C(C)c1ccc(cc1F)SC 271570a_100000694244_100009816902 [0,2,0,0,0,0|1,0,0]=3 5472 B12R1.452 C=C(C)c1ccc(cc1N)C#N 271570a_100000694244_100012001879 [0,2,0,0,0,0|1,0,1]=4 5473 B12R1.452 C=C(C)c1ccc(cc1N)CO 271570a_100000694244_100012347568 [0,2,0,0,0,0|1,0,0]=3 5474 B12R1.452 C=C(C)c1ccc(cc1N)OC 271570a_100000694244_100000748021 [0,2,0,0,0,0|1,0,0]=3 5475 B12R1.452 C=C(C)c1ccc(cc1O)C#N 271570a_100000694244_100000724445 [0,2,0,0,0,0|1,0,1]=4 5476 B12R1.452 C=C(C)c1ccc(cc1O)C=O 271570a_100000694244_100000041418 [0,2,0,0,0,0|1,0,1]=4 5477 B12R1.452 C=C(C)c1ccc(cc1O)CO 271570a_100000694244_100000049605 [0,2,0,0,0,0|1,0,0]=3 5478 B12R1.452 C=C(C)c1ccc(cc1O)OC 271570a_100000694244_100000719091 [0,2,0,0,0,0|1,0,0]=3 5479 B12R1.452 C=C(C)c1ccc(nc1C)CO 271570a_100000694244_100010114280 [0,2,0,0,0,0|2,0,0]=4 5480 B12R1.452 C=C(C)c1ccc(nc1C)OC 271570a_100000694244_100000766551 [0,2,0,0,0,0|2,0,0]=4 5481 B12R1.452 C=C(C)c1ccc(nc1F)OC 271570a_100000694244_100010067559 [0,2,0,0,0,0|2,0,0]=4 5482 B12R1.452 C=C(C)c1ccc(nc1N)OC 271570a_100000694244_100010187629 [0,2,0,0,0,0|2,0,0]=4 5483 B12R1.452 C=C(C)c1cnc(cc1C)CO 271570a_100000694244_200010713146 [0,2,0,0,0,0|2,0,0]=4 5484 B12R1.452 C=C(C)c1cnc(cc1C)NC 271570a_100000694244_100012352278 [0,2,0,0,0,0|2,0,0]=4 5485 B12R1.452 C=C(C)c1cnc(cc1C)OC 271570a_100000694244_100011934368 [0,2,0,0,0,0|2,0,0]=4 5486 B12R1.452 C=C(C)c1cnc(cc1F)OC 271570a_100000694244_100010136277 [0,2,0,0,0,0|2,0,0]=4 5487 B12R1.452 C=C(C)c1cnc(cc1N)OC 271570a_100000694244_100010254562 [0,2,0,0,0,0|2,0,0]=4 5488 B12R1.452 C=C(C)c1cnc(cc1O)OC 271570a_100000694244_100010738159 [0,2,0,0,0,0|2,0,0]=4 5489 B12R1.452 C=C(C)c1ncc(cc1C)CO 271570a_100000694244_200000092119 [0,2,0,0,0,0|2,0,0]=4 5490 B12R1.452 C=C(C)c1ncc(cc1C)OC 271570a_100000694244_200009851512 [0,2,0,0,0,0|2,0,0]=4 5491 B12R1.452 C=C(C)c1ncc(cc1C)SC 271570a_100000694244_203440288091 [0,2,0,0,0,0|2,0,0]=4 5492 B12R1.452 C=C(C)c1ncc(cc1F)CO 271570a_100000694244_100010065243 [0,2,0,0,0,0|2,0,0]=4 5493 B12R1.452 C=C(C)c1ncc(cc1F)SC 271570a_100000694244_100010884644 [0,2,0,0,0,0|2,0,0]=4 5494 B12R1.452 C=C(C)c1ncc(cc1N)OC 271570a_100000694244_100010074831 [0,2,0,0,0,0|2,0,0]=4 5495 B12R1.452 C=Cc1ccc(c(c1)Br)C(=O)N 271570a_100011290941_200010146565 [0,2,0,0,0,0|1,0,1]=4 5496 B12R1.452 C=Cc1ccc(c(c1)C)C(=O)C 271570a_100011290941_100012360112 [0,2,0,0,0,0|0,0,1]=3 5497 B12R1.452 C=Cc1ccc(c(c1)C)C(=O)N 271570a_100011290941_100011327924 [0,2,0,0,0,0|1,0,1]=4 5498 B12R1.452 C=Cc1ccc(c(c1)F)C(=O)C 271570a_100011290941_100000690205 [0,2,0,0,0,0|0,0,1]=3 5499 B12R1.452 C=Cc1ccc(c(c1)F)C(=O)N 271570a_100011290941_100000216903 [0,2,0,0,0,0|1,0,1]=4 5500 B12R1.452 C=Cc1ccc(c(c1)N)C(=O)C 271570a_100011290941_100011590516 [0,2,0,0,0,0|0,0,1]=3 5501 B12R1.452 C=Cc1ccc(c(c1)N)C(=O)N 271570a_100011290941_100012349972 [0,2,0,0,0,0|1,0,1]=4 5502 B12R1.452 C=Cc1ccc(c(c1)O)C(=O)C 271570a_100011290941_100000188348 [0,2,0,0,0,0|0,0,1]=3 5503 B12R1.452 C=Cc1ccc(c(c1)O)C(=O)N 271570a_100011290941_100011550861 [0,2,0,0,0,0|1,0,1]=4 5504 B12R1.452 C=Cc1cnc(c(c1)F)C(=O)C 271570a_100011290941_100000696590 [0,2,0,0,0,0|1,0,1]=4 5505 B12R1.452 CC(=O)c1ccc(cc1Br)C#N 1458a_100010244945_200000210301 [0,2,0,0,0,0|0,0,1]=3 5506 B12R1.452 CC(=O)c1ccc(cc1Br)O[13CH3] 34a_100012340537_200025704644 [0,2,0,0,0,0|0,0,0]=2 5507 B12R1.452 CC(=O)c1ccc(cc1Br)O[13CH3] 7a_100012340537_200025704644 [0,2,0,0,0,0|0,0,0]=2 5508 B12R1.452 CC(=O)c1ccc(cc1C)C#N 1458a_100000691869_200000210301 [0,2,0,0,0,0|0,0,1]=3 5509 B12R1.452 CC(=O)c1ccc(cc1C)O[13CH3] 34a_100000702595_200025704644 [0,2,0,0,0,0|0,0,0]=2 5510 B12R1.452 CC(=O)c1ccc(cc1C)O[13CH3] 7a_100000702595_200025704644 [0,2,0,0,0,0|0,0,0]=2 5511 B12R1.452 CC(=O)c1ccc(cc1C)S[13CH3] 62a_100012360112_200025704644 [0,2,0,0,0,0|0,0,0]=2 5512 B12R1.452 CC(=O)c1ccc(cc1C)S[13CH3] 62a_200025704644_100012360112 [0,2,0,0,0,0|0,0,0]=2 5513 B12R1.452 CC(=O)c1ccc(cc1Cl)C#N 1458a_100000100588_200000210301 [0,2,0,0,0,0|0,0,1]=3 5514 B12R1.452 CC(=O)c1ccc(cc1Cl)CO 1458a_100015659073_200000210301 [0,2,0,0,0,0|0,0,0]=2 5515 B12R1.452 CC(=O)c1ccc(cc1Cl)O[13CH3] 34a_100011933989_200025704644 [0,2,0,0,0,0|0,0,0]=2 5516 B12R1.452 CC(=O)c1ccc(cc1Cl)O[13CH3] 7a_100011933989_200025704644 [0,2,0,0,0,0|0,0,0]=2 5517 B12R1.452 CC(=O)c1ccc(cc1F)C#N 1458a_100000238375_200000210301 [0,2,0,0,0,0|0,0,1]=3 5518 B12R1.452 CC(=O)c1ccc(cc1F)CO 1458a_100011934814_200000210301 [0,2,0,0,0,0|0,0,0]=2 5519 B12R1.452 CC(=O)c1ccc(cc1F)O[13CH3] 34a_100000752407_200025704644 [0,2,0,0,0,0|0,0,0]=2 5520 B12R1.452 CC(=O)c1ccc(cc1F)O[13CH3] 7a_100000752407_200025704644 [0,2,0,0,0,0|0,0,0]=2 5521 B12R1.452 CC(=O)c1ccc(cc1F)S[13CH3] 62a_100000690205_200025704644 [0,2,0,0,0,0|0,0,0]=2 5522 B12R1.452 CC(=O)c1ccc(cc1N)S[13CH3] 62a_100011590516_200025704644 [0,2,0,0,0,0|0,0,0]=2 5523 B12R1.452 CC(=O)c1ncc(cc1F)S[13CH3] 62a_100000696590_200025704644 [0,2,0,0,0,0|1,0,0]=3 5524 B12R1.452 CC(=O)c1ncc(cc1F)S[13CH3] 62a_200025704644_100000696590 [0,2,0,0,0,0|1,0,0]=3 5525 B12R1.452 CC(N)c1ccc(cc1F)S[13CH3] 62a_100000730447_200025704644 [0,2,0,0,0,0|1,0,1]=4 5526 B12R1.452 CC(N)c1ccc(cc1F)S[13CH3] 62a_200025704644_100000730447 [0,2,0,0,0,0|1,0,1]=4 5527 B12R1.452 CCc1ccc(c(c1)F)C(=O)C 1458a_200009867912_200000210301 [0,2,0,0,0,0|0,0,0]=2 5528 B12R1.452 CCc1ccc(c(c1)F)C(=O)[13CH3] 1458a_200009867912_200025704644 [0,2,0,0,0,0|0,0,0]=2 5529 B12R1.452 CN(C)c1ccc(cc1Cl)N[13CH3] 34a_100000742791_200025704644 [0,2,0,0,0,0|2,0,0]=4 5530 B12R1.452 CN(C)c1ccc(cc1F)N[13CH3] 34a_100011248830_200025704644 [0,2,0,0,0,0|2,0,0]=4 5531 B12R1.452 CN(C)c1ccc(cc1N)S[13CH3] 62a_100000737018_200025704644 [0,2,0,0,0,0|2,0,0]=4 5532 B12R1.452 CN(C)c1ccc(cc1N)S[13CH3] 62a_200025704644_100000737018 [0,2,0,0,0,0|2,0,0]=4 5533 B12R1.452 CNc1cc(c(cn1)C(=O)N)C 27a_100102657272_200134614278 [0,2,0,0,0,0|2,0,0]=4 5534 B12R1.452 CNc1ccc(c(c1)Br)C(=O)N 27a_100102657272_200010146565 [0,2,0,0,0,0|1,0,0]=3 5535 B12R1.452 CNc1ccc(c(c1)Br)[N+](=O)[O-] 7a_100000693983_200000210301 [0,2,0,0,0,0|2,0,0]=4 5536 B12R1.452 CNc1ccc(c(c1)C)C(=O)N 27a_100102657272_100011327924 [0,2,0,0,0,0|1,0,0]=3 5537 B12R1.452 CNc1ccc(c(c1)C)C(=O)N 34a_200000751758_200000210301 [0,2,0,0,0,0|1,0,0]=3 5538 B12R1.452 CNc1ccc(c(c1)C)C(=O)N 7a_200000751758_200000210301 [0,2,0,0,0,0|1,0,0]=3 5539 B12R1.452 CNc1ccc(c(c1)C)C(C)C 2230a_100000005830_200000210301 [0,2,0,0,0,0|1,0,1]=4 5540 B12R1.452 CNc1ccc(c(c1)C)C(C)C 34a_100000005830_200000210301 [0,2,0,0,0,0|1,0,1]=4 5541 B12R1.452 CNc1ccc(c(c1)C)C(C)C 7a_100000005830_200000210301 [0,2,0,0,0,0|1,0,1]=4 5542 B12R1.452 CNc1ccc(c(c1)C)N(C)C 34a_100000738307_200000210301 [0,2,0,0,0,0|2,0,0]=4 5543 B12R1.452 CNc1ccc(c(c1)C)[N+](=O)[O-] 34a_100000745639_200000210301 [0,2,0,0,0,0|2,0,0]=4 5544 B12R1.452 CNc1ccc(c(c1)C)[N+](=O)[O-] 7a_100000745639_200000210301 [0,2,0,0,0,0|2,0,0]=4 5545 B12R1.452 CNc1ccc(c(c1)Cl)C(=O)N 34a_100000737725_200000210301 [0,2,0,0,0,0|1,0,0]=3 5546 B12R1.452 CNc1ccc(c(c1)Cl)C(=O)N 7a_100000737725_200000210301 [0,2,0,0,0,0|1,0,0]=3 5547 B12R1.452 CNc1ccc(c(c1)Cl)N(C)C 34a_100000742791_200000210301 [0,2,0,0,0,0|2,0,0]=4 5548 B12R1.452 CNc1ccc(c(c1)F)C(=O)C 27a_100102657272_100000690205 [0,2,0,0,0,0|0,0,0]=2 5549 B12R1.452 CNc1ccc(c(c1)F)C(=O)N 27a_100102657272_100000216903 [0,2,0,0,0,0|1,0,0]=3 5550 B12R1.452 CNc1ccc(c(c1)F)C(=O)N 34a_100000749959_200000210301 [0,2,0,0,0,0|1,0,0]=3 5551 B12R1.452 CNc1ccc(c(c1)F)C(=O)N 7a_100000749959_200000210301 [0,2,0,0,0,0|1,0,0]=3 5552 B12R1.452 CNc1ccc(c(c1)F)N(C)C 34a_100011248830_200000210301 [0,2,0,0,0,0|2,0,0]=4 5553 B12R1.452 CNc1ccc(c(c1)F)[N+](=O)[O-] 34a_100000741728_200000210301 [0,2,0,0,0,0|2,0,0]=4 5554 B12R1.452 CNc1ccc(c(c1)F)[N+](=O)[O-] 7a_100000741728_200000210301 [0,2,0,0,0,0|2,0,0]=4 5555 B12R1.452 CNc1ccc(c(c1)O)C(=O)N 34a_100000223280_200000210301 [0,2,0,0,0,0|1,0,0]=3 5556 B12R1.452 CNc1ccc(c(c1)O)C(=O)N 7a_100000223280_200000210301 [0,2,0,0,0,0|1,0,0]=3 5557 B12R1.452 CNc1ccc(c(n1)N)C(=O)N 27a_100102657272_100009875182 [0,2,0,0,0,0|2,0,0]=4 5558 B12R1.452 CNc1cnc(c(c1)F)C(=O)N 27a_100102657272_200010161073 [0,2,0,0,0,0|2,0,0]=4 5559 B12R1.452 COc1ccc(c(c1)Br)C(=O)C 1458a_100000748873_200000210301 [0,2,0,0,0,0|0,0,0]=2 5560 B12R1.452 COc1ccc(c(c1)Br)C(=O)C 34a_100012340537_200000210301 [0,2,0,0,0,0|0,0,0]=2 5561 B12R1.452 COc1ccc(c(c1)Br)C(=O)C 7a_100012340537_200000210301 [0,2,0,0,0,0|0,0,0]=2 5562 B12R1.452 COc1ccc(c(c1)Br)C(=O)[13CH3] 1458a_100000748873_200025704644 [0,2,0,0,0,0|0,0,0]=2 5563 B12R1.452 COc1ccc(c(c1)Br)[N+](=O)[O-] 34a_100012356988_200000210301 [0,2,0,0,0,0|2,0,0]=4 5564 B12R1.452 COc1ccc(c(c1)Br)[N+](=O)[O-] 7a_100012356988_200000210301 [0,2,0,0,0,0|2,0,0]=4 5565 B12R1.452 COc1ccc(c(c1)C)C(=O)C 1458a_100000763155_200000210301 [0,2,0,0,0,0|0,0,0]=2 5566 B12R1.452 COc1ccc(c(c1)C)C(=O)C 34a_100000702595_200000210301 [0,2,0,0,0,0|0,0,0]=2 5567 B12R1.452 COc1ccc(c(c1)C)C(=O)C 7a_100000702595_200000210301 [0,2,0,0,0,0|0,0,0]=2 5568 B12R1.452 COc1ccc(c(c1)C)C(=O)[13CH3] 1458a_100000763155_200025704644 [0,2,0,0,0,0|0,0,0]=2 5569 B12R1.452 COc1ccc(c(c1)C)C(C)C 34a_100000210824_200000210301 [0,2,0,0,0,0|1,0,1]=4 5570 B12R1.452 COc1ccc(c(c1)C)C(C)C 7a_100000210824_200000210301 [0,2,0,0,0,0|1,0,1]=4 5571 B12R1.452 COc1ccc(c(c1)C)N(C)C 2230a_103496583619_200000210301 [0,2,0,0,0,0|2,0,0]=4 5572 B12R1.452 COc1ccc(c(c1)C)N(C)C 269982a_103496583619_200000210301 [0,2,0,0,0,0|2,0,0]=4 5573 B12R1.452 COc1ccc(c(c1)C)N(C)C 34a_103496583619_200000210301 [0,2,0,0,0,0|2,0,0]=4 5574 B12R1.452 COc1ccc(c(c1)C)N(C)C 38a_103496583619_200000210301 [0,2,0,0,0,0|2,0,0]=4 5575 B12R1.452 COc1ccc(c(c1)C)N(C)[13CH3] 2230a_103496583619_200025704644 [0,2,0,0,0,0|2,0,0]=4 5576 B12R1.452 COc1ccc(c(c1)C)N(C)[13CH3] 269982a_103496583619_200025704644 [0,2,0,0,0,0|2,0,0]=4 5577 B12R1.452 COc1ccc(c(c1)C)N(C)[13CH3] 34a_103496583619_200025704644 [0,2,0,0,0,0|2,0,0]=4 5578 B12R1.452 COc1ccc(c(c1)C)N(C)[13CH3] 38a_103496583619_200025704644 [0,2,0,0,0,0|2,0,0]=4 5579 B12R1.452 COc1ccc(c(c1)C)[N+](=O)[O-] 34a_100000195451_200000210301 [0,2,0,0,0,0|2,0,0]=4 5580 B12R1.452 COc1ccc(c(c1)C)[N+](=O)[O-] 7a_100000195451_200000210301 [0,2,0,0,0,0|2,0,0]=4 5581 B12R1.452 COc1ccc(c(c1)Cl)C(=O)C 1458a_100000753557_200000210301 [0,2,0,0,0,0|0,0,0]=2 5582 B12R1.452 COc1ccc(c(c1)Cl)C(=O)C 34a_100011933989_200000210301 [0,2,0,0,0,0|0,0,0]=2 5583 B12R1.452 COc1ccc(c(c1)Cl)C(=O)C 7a_100011933989_200000210301 [0,2,0,0,0,0|0,0,0]=2 5584 B12R1.452 COc1ccc(c(c1)Cl)C(=O)N 34a_100011997949_200000210301 [0,2,0,0,0,0|1,0,0]=3 5585 B12R1.452 COc1ccc(c(c1)Cl)C(=O)N 7a_100011997949_200000210301 [0,2,0,0,0,0|1,0,0]=3 5586 B12R1.452 COc1ccc(c(c1)Cl)C(=O)[13CH3] 1458a_100000753557_200025704644 [0,2,0,0,0,0|0,0,0]=2 5587 B12R1.452 COc1ccc(c(c1)Cl)[N+](=O)[O-] 34a_100000746235_200000210301 [0,2,0,0,0,0|2,0,0]=4 5588 B12R1.452 COc1ccc(c(c1)Cl)[N+](=O)[O-] 7a_100000746235_200000210301 [0,2,0,0,0,0|2,0,0]=4 5589 B12R1.452 COc1ccc(c(c1)F)C(=O)C 1458a_100000198494_200000210301 [0,2,0,0,0,0|0,0,0]=2 5590 B12R1.452 COc1ccc(c(c1)F)C(=O)C 34a_100000752407_200000210301 [0,2,0,0,0,0|0,0,0]=2 5591 B12R1.452 COc1ccc(c(c1)F)C(=O)C 7a_100000752407_200000210301 [0,2,0,0,0,0|0,0,0]=2 5592 B12R1.452 COc1ccc(c(c1)F)C(=O)N 34a_200012186767_200000210301 [0,2,0,0,0,0|1,0,0]=3 5593 B12R1.452 COc1ccc(c(c1)F)C(=O)N 7a_200012186767_200000210301 [0,2,0,0,0,0|1,0,0]=3 5594 B12R1.452 COc1ccc(c(c1)F)C(=O)[13CH3] 1458a_100000198494_200025704644 [0,2,0,0,0,0|0,0,0]=2 5595 B12R1.452 COc1ccc(c(c1)F)[N+](=O)[O-] 7a_100000745333_200000210301 [0,2,0,0,0,0|2,0,0]=4 5596 B12R1.452 COc1ccc(c(c1)I)C(=O)C 1458a_100000688016_200000210301 [0,2,0,0,0,0|0,0,0]=2 5597 B12R1.452 COc1ccc(c(c1)I)C(=O)[13CH3] 1458a_100000688016_200025704644 [0,2,0,0,0,0|0,0,0]=2 5598 B12R1.452 COc1ccc(c(c1)I)[N+](=O)[O-] 7a_100010243554_200000210301 [0,2,0,0,0,0|2,0,0]=4 5599 B12R1.452 COc1ccc(c(c1)N)C(=O)N 34a_100012186684_200000210301 [0,2,0,0,0,0|1,0,0]=3 5600 B12R1.452 COc1ccc(c(c1)N)C(=O)N 7a_100012186684_200000210301 [0,2,0,0,0,0|1,0,0]=3 5601 B12R1.452 COc1ccc(c(c1)N)[N+](=O)[O-] 7a_100000729835_200000210301 [0,2,0,0,0,0|2,0,0]=4 5602 B12R1.452 COc1ccc(c(c1)O)C(=O)C 1458a_100000212123_200000210301 [0,2,0,0,0,0|0,0,0]=2 5603 B12R1.452 COc1ccc(c(c1)O)C(=O)C 271570a_203496583355_100000697255 [0,2,0,0,0,0|0,0,0]=2 5604 B12R1.452 COc1ccc(c(c1)O)C(=O)N 271570a_203496583355_200009815664 [0,2,0,0,0,0|1,0,0]=3 5605 B12R1.452 COc1ccc(c(c1)O)C(=O)[13CH3] 1458a_100000212123_200025704644 [0,2,0,0,0,0|0,0,0]=2 5606 B12R1.452 COc1ccc(c(c1)O)C(C)O 271570a_203496583355_100000697252 [0,2,0,0,0,0|0,0,2]=4 5607 B12R1.452 CSc1cc(c(cn1)C(=O)N)C 62a_200000210301_200134614278 [0,2,0,0,0,0|2,0,0]=4 5608 B12R1.452 CSc1cc(c(cn1)C(=O)N)C 62a_200134614278_200000210301 [0,2,0,0,0,0|2,0,0]=4 5609 B12R1.452 CSc1ccc(c(c1)Br)C(=O)N 62a_200010146565_200000210301 [0,2,0,0,0,0|1,0,0]=3 5610 B12R1.452 CSc1ccc(c(c1)C)C(=O)C 1458a_100012278374_200000210301 [0,2,0,0,0,0|0,0,0]=2 5611 B12R1.452 CSc1ccc(c(c1)C)C(=O)C 62a_100012360112_200000210301 [0,2,0,0,0,0|0,0,0]=2 5612 B12R1.452 CSc1ccc(c(c1)C)C(=O)C 62a_200000210301_100012360112 [0,2,0,0,0,0|0,0,0]=2 5613 B12R1.452 CSc1ccc(c(c1)C)C(=O)N 62a_100011327924_200000210301 [0,2,0,0,0,0|1,0,0]=3 5614 B12R1.452 CSc1ccc(c(c1)C)C(=O)N 62a_200000210301_100011327924 [0,2,0,0,0,0|1,0,0]=3 5615 B12R1.452 CSc1ccc(c(c1)C)C(=O)[13CH3] 1458a_100012278374_200025704644 [0,2,0,0,0,0|0,0,0]=2 5616 B12R1.452 CSc1ccc(c(c1)F)C(=O)C 62a_100000690205_200000210301 [0,2,0,0,0,0|0,0,0]=2 5617 B12R1.452 CSc1ccc(c(c1)F)C(=O)N 62a_100000216903_200000210301 [0,2,0,0,0,0|1,0,0]=3 5618 B12R1.452 CSc1ccc(c(c1)F)C(C)N 62a_100000730447_200000210301 [0,2,0,0,0,0|1,0,1]=4 5619 B12R1.452 CSc1ccc(c(c1)F)C(C)N 62a_200000210301_100000730447 [0,2,0,0,0,0|1,0,1]=4 5620 B12R1.452 CSc1ccc(c(c1)N)C(=O)C 62a_100011590516_200000210301 [0,2,0,0,0,0|0,0,0]=2 5621 B12R1.452 CSc1ccc(c(c1)N)C(=O)N 62a_100012349972_200000210301 [0,2,0,0,0,0|1,0,0]=3 5622 B12R1.452 CSc1ccc(c(c1)N)N(C)C 62a_100000737018_200000210301 [0,2,0,0,0,0|2,0,0]=4 5623 B12R1.452 CSc1ccc(c(c1)N)N(C)C 62a_200000210301_100000737018 [0,2,0,0,0,0|2,0,0]=4 5624 B12R1.452 CSc1ccc(c(c1)O)C(=O)N 62a_100011550861_200000210301 [0,2,0,0,0,0|1,0,0]=3 5625 B12R1.452 CSc1ccc(c(n1)N)C(=O)N 62a_100009875182_200000210301 [0,2,0,0,0,0|2,0,0]=4 5626 B12R1.452 CSc1cnc(c(c1)F)C(=O)C 62a_100000696590_200000210301 [0,2,0,0,0,0|1,0,0]=3 5627 B12R1.452 CSc1cnc(c(c1)F)C(=O)C 62a_200000210301_100000696590 [0,2,0,0,0,0|1,0,0]=3 5628 B12R1.452 CSc1cnc(c(c1)F)C(=O)N 62a_200000210301_200010161073 [0,2,0,0,0,0|2,0,0]=4 5629 B12R1.452 CSc1cnc(c(c1)F)C(=O)N 62a_200010161073_200000210301 [0,2,0,0,0,0|2,0,0]=4 5630 B12R1.452 CSc1cnc(c(c1)N)C(=O)N 62a_100010235749_200000210301 [0,2,0,0,0,0|2,0,0]=4 5631 B12R1.452 CSc1cnc(c(c1)N)C(=O)N 62a_200000210301_100010235749 [0,2,0,0,0,0|2,0,0]=4 5632 B12R1.452 Cc1cc(ccc1C(=O)N)N[13CH3] 34a_200000751758_200025704644 [0,2,0,0,0,0|1,0,0]=3 5633 B12R1.452 Cc1cc(ccc1C(=O)N)N[13CH3] 7a_200000751758_200025704644 [0,2,0,0,0,0|1,0,0]=3 5634 B12R1.452 Cc1cc(ccc1C(=O)N)S[13CH3] 62a_100011327924_200025704644 [0,2,0,0,0,0|1,0,0]=3 5635 B12R1.452 Cc1cc(ccc1C(=O)N)S[13CH3] 62a_200025704644_100011327924 [0,2,0,0,0,0|1,0,0]=3 5636 B12R1.452 Cc1cc(ccc1C(=O)[13CH3])C#N 1458a_100000691869_200025704644 [0,2,0,0,0,0|0,0,1]=3 5637 B12R1.452 Cc1cc(ccc1C(C)C)N[13CH3] 2230a_100000005830_200025704644 [0,2,0,0,0,0|1,0,1]=4 5638 B12R1.452 Cc1cc(ccc1C(C)C)N[13CH3] 34a_100000005830_200025704644 [0,2,0,0,0,0|1,0,1]=4 5639 B12R1.452 Cc1cc(ccc1C(C)C)N[13CH3] 7a_100000005830_200025704644 [0,2,0,0,0,0|1,0,1]=4 5640 B12R1.452 Cc1cc(ccc1C(C)C)O[13CH3] 34a_100000210824_200025704644 [0,2,0,0,0,0|1,0,1]=4 5641 B12R1.452 Cc1cc(ccc1C(C)C)O[13CH3] 7a_100000210824_200025704644 [0,2,0,0,0,0|1,0,1]=4 5642 B12R1.452 Cc1cc(ccc1N(C)C)N[13CH3] 34a_100000738307_200025704644 [0,2,0,0,0,0|2,0,0]=4 5643 B12R1.452 Cc1cc(ccc1[N+](=O)[O-])N[13CH3] 34a_100000745639_200025704644 [0,2,0,0,0,0|2,0,0]=4 5644 B12R1.452 Cc1cc(ccc1[N+](=O)[O-])N[13CH3] 7a_100000745639_200025704644 [0,2,0,0,0,0|2,0,0]=4 5645 B12R1.452 Cc1cc(ccc1[N+](=O)[O-])O[13CH3] 34a_100000195451_200025704644 [0,2,0,0,0,0|2,0,0]=4 5646 B12R1.452 Cc1cc(ccc1[N+](=O)[O-])O[13CH3] 7a_100000195451_200025704644 [0,2,0,0,0,0|2,0,0]=4 5647 B12R1.452 Cc1cc(ncc1C(=O)N)S[13CH3] 62a_200025704644_200134614278 [0,2,0,0,0,0|2,0,0]=4 5648 B12R1.452 Cc1cc(ncc1C(=O)N)S[13CH3] 62a_200134614278_200025704644 [0,2,0,0,0,0|2,0,0]=4 5649 B12R1.452 [13CH3]C(=O)c1ccc(cc1Br)C#N 1458a_100010244945_200025704644 [0,2,0,0,0,0|0,0,1]=3 5650 B12R1.452 [13CH3]C(=O)c1ccc(cc1Cl)C#N 1458a_100000100588_200025704644 [0,2,0,0,0,0|0,0,1]=3 5651 B12R1.452 [13CH3]C(=O)c1ccc(cc1Cl)CO 1458a_100015659073_200025704644 [0,2,0,0,0,0|0,0,0]=2 5652 B12R1.452 [13CH3]C(=O)c1ccc(cc1F)C#N 1458a_100000238375_200025704644 [0,2,0,0,0,0|0,0,1]=3 5653 B12R1.452 [13CH3]C(=O)c1ccc(cc1F)CO 1458a_100011934814_200025704644 [0,2,0,0,0,0|0,0,0]=2 5654 B12R1.452 [13CH3]Nc1ccc(c(c1)Br)[N+](=O)[O-] 7a_100000693983_200025704644 [0,2,0,0,0,0|2,0,0]=4 5655 B12R1.452 [13CH3]Nc1ccc(c(c1)Cl)C(=O)N 34a_100000737725_200025704644 [0,2,0,0,0,0|1,0,0]=3 5656 B12R1.452 [13CH3]Nc1ccc(c(c1)Cl)C(=O)N 7a_100000737725_200025704644 [0,2,0,0,0,0|1,0,0]=3 5657 B12R1.452 [13CH3]Nc1ccc(c(c1)F)C(=O)N 34a_100000749959_200025704644 [0,2,0,0,0,0|1,0,0]=3 5658 B12R1.452 [13CH3]Nc1ccc(c(c1)F)C(=O)N 7a_100000749959_200025704644 [0,2,0,0,0,0|1,0,0]=3 5659 B12R1.452 [13CH3]Nc1ccc(c(c1)F)[N+](=O)[O-] 34a_100000741728_200025704644 [0,2,0,0,0,0|2,0,0]=4 5660 B12R1.452 [13CH3]Nc1ccc(c(c1)F)[N+](=O)[O-] 7a_100000741728_200025704644 [0,2,0,0,0,0|2,0,0]=4 5661 B12R1.452 [13CH3]Nc1ccc(c(c1)O)C(=O)N 34a_100000223280_200025704644 [0,2,0,0,0,0|1,0,0]=3 5662 B12R1.452 [13CH3]Nc1ccc(c(c1)O)C(=O)N 7a_100000223280_200025704644 [0,2,0,0,0,0|1,0,0]=3 5663 B12R1.452 [13CH3]Oc1ccc(c(c1)Br)[N+](=O)[O-] 34a_100012356988_200025704644 [0,2,0,0,0,0|2,0,0]=4 5664 B12R1.452 [13CH3]Oc1ccc(c(c1)Br)[N+](=O)[O-] 7a_100012356988_200025704644 [0,2,0,0,0,0|2,0,0]=4 5665 B12R1.452 [13CH3]Oc1ccc(c(c1)Cl)C(=O)N 34a_100011997949_200025704644 [0,2,0,0,0,0|1,0,0]=3 5666 B12R1.452 [13CH3]Oc1ccc(c(c1)Cl)C(=O)N 7a_100011997949_200025704644 [0,2,0,0,0,0|1,0,0]=3 5667 B12R1.452 [13CH3]Oc1ccc(c(c1)Cl)[N+](=O)[O-] 34a_100000746235_200025704644 [0,2,0,0,0,0|2,0,0]=4 5668 B12R1.452 [13CH3]Oc1ccc(c(c1)Cl)[N+](=O)[O-] 7a_100000746235_200025704644 [0,2,0,0,0,0|2,0,0]=4 5669 B12R1.452 [13CH3]Oc1ccc(c(c1)F)C(=O)N 34a_200012186767_200025704644 [0,2,0,0,0,0|1,0,0]=3 5670 B12R1.452 [13CH3]Oc1ccc(c(c1)F)C(=O)N 7a_200012186767_200025704644 [0,2,0,0,0,0|1,0,0]=3 5671 B12R1.452 [13CH3]Oc1ccc(c(c1)F)[N+](=O)[O-] 7a_100000745333_200025704644 [0,2,0,0,0,0|2,0,0]=4 5672 B12R1.452 [13CH3]Oc1ccc(c(c1)I)[N+](=O)[O-] 7a_100010243554_200025704644 [0,2,0,0,0,0|2,0,0]=4 5673 B12R1.452 [13CH3]Oc1ccc(c(c1)N)C(=O)N 34a_100012186684_200025704644 [0,2,0,0,0,0|1,0,0]=3 5674 B12R1.452 [13CH3]Oc1ccc(c(c1)N)C(=O)N 7a_100012186684_200025704644 [0,2,0,0,0,0|1,0,0]=3 5675 B12R1.452 [13CH3]Oc1ccc(c(c1)N)[N+](=O)[O-] 7a_100000729835_200025704644 [0,2,0,0,0,0|2,0,0]=4 5676 B12R1.452 [13CH3]Sc1ccc(c(c1)Br)C(=O)N 62a_200010146565_200025704644 [0,2,0,0,0,0|1,0,0]=3 5677 B12R1.452 [13CH3]Sc1ccc(c(c1)F)C(=O)N 62a_100000216903_200025704644 [0,2,0,0,0,0|1,0,0]=3 5678 B12R1.452 [13CH3]Sc1ccc(c(c1)N)C(=O)N 62a_100012349972_200025704644 [0,2,0,0,0,0|1,0,0]=3 5679 B12R1.452 [13CH3]Sc1ccc(c(c1)O)C(=O)N 62a_100011550861_200025704644 [0,2,0,0,0,0|1,0,0]=3 5680 B12R1.452 [13CH3]Sc1ccc(c(n1)N)C(=O)N 62a_100009875182_200025704644 [0,2,0,0,0,0|2,0,0]=4 5681 B12R1.452 [13CH3]Sc1cnc(c(c1)F)C(=O)N 62a_200010161073_200025704644 [0,2,0,0,0,0|2,0,0]=4 5682 B12R1.452 [13CH3]Sc1cnc(c(c1)F)C(=O)N 62a_200025704644_200010161073 [0,2,0,0,0,0|2,0,0]=4 5683 B12R1.452 [13CH3]Sc1cnc(c(c1)N)C(=O)N 62a_100010235749_200025704644 [0,2,0,0,0,0|2,0,0]=4 5684 B12R1.452 [13CH3]Sc1cnc(c(c1)N)C(=O)N 62a_200025704644_100010235749 [0,2,0,0,0,0|2,0,0]=4 5685 B12R1.9 CC(C)(C=O)c1ccc(cc1)O 271570a_203496583355_100010228009 [0,2,0,0,0,0|1,0,1]=4 5686 B12R1.9 CCS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000765143 [0,2,0,0,0,0|2,0,0]=4 5687 B12R1.9 CNC(C)(C)c1ccc(cc1)C 2230a_200011345931_200000210301 [0,2,0,0,0,0|1,0,1]=4 5688 B12R1.9 CNC(C)(C)c1ccc(cc1)C 34a_200011345931_200000210301 [0,2,0,0,0,0|1,0,1]=4 5689 B12R1.9 CNS(=O)(=O)c1ccc(cc1)Br 270084a_100102657272_100000182491 [0,2,0,0,0,0|2,0,0]=4 5690 B12R1.9 CNS(=O)(=O)c1ccc(cc1)Br 274078a_100102657272_100000182491 [0,2,0,0,0,0|2,0,0]=4 5691 B12R1.9 CNS(=O)(=O)c1ccc(cc1)Br 40a_100102657272_100010306709 [0,2,0,0,0,0|2,0,0]=4 5692 B12R1.9 CNS(=O)(=O)c1ccc(cc1)C 270084a_100102657272_100000211267 [0,2,0,0,0,0|1,0,0]=3 5693 B12R1.9 CNS(=O)(=O)c1ccc(cc1)C 274078a_100102657272_100000211267 [0,2,0,0,0,0|1,0,0]=3 5694 B12R1.9 CNS(=O)(=O)c1ccc(cc1)C 40a_100102657272_100000039673 [0,2,0,0,0,0|1,0,0]=3 5695 B12R1.9 CNS(=O)(=O)c1ccc(cc1)Cl 270084a_100102657272_100000209962 [0,2,0,0,0,0|2,0,0]=4 5696 B12R1.9 CNS(=O)(=O)c1ccc(cc1)Cl 274078a_100102657272_100000209962 [0,2,0,0,0,0|2,0,0]=4 5697 B12R1.9 CNS(=O)(=O)c1ccc(cc1)Cl 40a_100102657272_100000077732 [0,2,0,0,0,0|2,0,0]=4 5698 B12R1.9 CNS(=O)(=O)c1ccc(cc1)F 270084a_100102657272_100000184267 [0,2,0,0,0,0|2,0,0]=4 5699 B12R1.9 CNS(=O)(=O)c1ccc(cc1)F 274078a_100102657272_100000184267 [0,2,0,0,0,0|2,0,0]=4 5700 B12R1.9 CNS(=O)(=O)c1ccc(cc1)F 40a_100102657272_100000081159 [0,2,0,0,0,0|2,0,0]=4 5701 B12R1.9 CNS(=O)(=O)c1ccc(cc1)I 270084a_100102657272_100011205396 [0,2,0,0,0,0|2,0,0]=4 5702 B12R1.9 CNS(=O)(=O)c1ccc(cc1)I 274078a_100102657272_100011205396 [0,2,0,0,0,0|2,0,0]=4 5703 B12R1.9 CNS(=O)(=O)c1ccc(cc1)N 40a_100102657272_100000054796 [0,2,0,0,0,0|2,0,0]=4 5704 B12R1.9 CNS(=O)(=O)c1ccc(cc1)O 270084a_100102657272_100020667864 [0,2,0,0,0,0|2,0,0]=4 5705 B12R1.9 CNS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000754977 [0,2,0,0,0,0|2,0,0]=4 5706 B12R1.9 CNS(=O)(=O)c1ccc(cc1)O 274078a_100102657272_100020667864 [0,2,0,0,0,0|2,0,0]=4 5707 B12R1.9 CNS(=O)(=O)c1ccc(nc1)C 270084a_100102657272_100000719016 [0,2,0,0,0,0|2,0,0]=4 5708 B12R1.9 CNS(=O)(=O)c1ccc(nc1)C 274078a_100102657272_100000719016 [0,2,0,0,0,0|2,0,0]=4 5709 B12R1.9 COC(C)(C)c1ccc(cc1)C 34a_200011345916_200000210301 [0,2,0,0,0,0|0,0,2]=4 5710 B12R1.9 COC(C)(C)c1ccc(cc1)C 7a_200011345916_200000210301 [0,2,0,0,0,0|0,0,2]=4 5711 B12R1.9 COS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000004522 [0,2,0,0,0,0|2,0,0]=4 5712 B12R1.9 Cc1ccc(cc1)C(C)(C)N[13CH3] 2230a_200011345931_200025704644 [0,2,0,0,0,0|1,0,1]=4 5713 B12R1.9 Cc1ccc(cc1)C(C)(C)N[13CH3] 34a_200011345931_200025704644 [0,2,0,0,0,0|1,0,1]=4 5714 B12R1.9 Cc1ccc(cc1)C(C)(C)O[13CH3] 34a_200011345916_200025704644 [0,2,0,0,0,0|0,0,2]=4 5715 B12R1.9 Cc1ccc(cc1)C(C)(C)O[13CH3] 7a_200011345916_200025704644 [0,2,0,0,0,0|0,0,2]=4 5716 B12R1.23 CS(=O)(=O)c1ccc(c(c1)F)O 271570a_203496583355_100010234714 [0,2,0,0,0,0|2,0,0]=4 5717 B12R1.23 CS(=O)(=O)c1ccc(c(c1)N)O 271570a_203496583355_200015322649 [0,2,0,0,0,0|2,0,0]=4 5718 B12R1.23 CS(=O)(=O)c1ccc(c(c1)O)F 271570a_203496583355_200000048130 [0,2,0,0,0,0|2,0,0]=4 5719 B12R1.23 CS(=O)(=O)c1ccc(c(c1)O)N 271570a_203496583355_100000743533 [0,2,0,0,0,0|2,0,0]=4 5720 B12R1.23 Cc1cc(ccc1O)S(=O)(=O)C 271570a_203496583355_200010713620 [0,2,0,0,0,0|2,0,0]=4 5721 B12R1.23 Cc1ccc(cc1O)S(=O)(=O)C 271570a_203496583355_100010175561 [0,2,0,0,0,0|1,0,0]=3 5722 B12R1.23 Cc1ccc(cc1O)S(=O)(=O)N 271570a_203496583355_100011847911 [0,2,0,0,0,0|2,0,0]=4 5723 B12R1.126 CS(=O)(=O)c1ccc(cc1F)O 271570a_203496583355_100010245844 [0,2,0,0,0,0|2,0,0]=4 5724 B12R1.126 CS(=O)(=O)c1ccc(cc1O)F 271570a_203496583355_100010175559 [0,2,0,0,0,0|2,0,0]=4 5725 B12R1.126 Cc1cc(ccc1S(=O)(=O)C)O 271570a_203496583355_100010713630 [0,2,0,0,0,0|2,0,0]=4 5726 B12R1.56 C#Cc1cc(ccc1C)C(=O)C 1458a_200012278110_200000210301 [0,2,0,0,0,0|0,0,0]=2 5727 B12R1.56 C#Cc1cc(ccc1C)C(=O)[13CH3] 1458a_200012278110_200025704644 [0,2,0,0,0,0|0,0,0]=2 5728 B12R1.56 C=C(C)c1cc(c(cn1)C)OC 271570a_100000694244_100010067687 [0,2,0,0,0,0|2,0,0]=4 5729 B12R1.56 C=C(C)c1ccc(c(c1)C#N)Br 271570a_100000694244_100012355174 [0,2,0,0,0,0|2,0,0]=4 5730 B12R1.56 C=C(C)c1ccc(c(c1)C#N)C 271570a_100000694244_100000698047 [0,2,0,0,0,0|1,0,0]=3 5731 B12R1.56 C=C(C)c1ccc(c(c1)C#N)Cl 271570a_100000694244_100011356831 [0,2,0,0,0,0|2,0,0]=4 5732 B12R1.56 C=C(C)c1ccc(c(c1)C#N)F 271570a_100000694244_100000037165 [0,2,0,0,0,0|2,0,0]=4 5733 B12R1.56 C=C(C)c1ccc(c(c1)C#N)N 271570a_100000694244_100000688460 [0,2,0,0,0,0|2,0,0]=4 5734 B12R1.56 C=C(C)c1ccc(c(c1)C#N)O 271570a_100000694244_100000687585 [0,2,0,0,0,0|2,0,0]=4 5735 B12R1.56 C=C(C)c1ccc(c(c1)C=O)Br 271570a_100000694244_100010185652 [0,2,0,0,0,0|2,0,0]=4 5736 B12R1.56 C=C(C)c1ccc(c(c1)C=O)C 271570a_100000694244_100011361606 [0,2,0,0,0,0|1,0,0]=3 5737 B12R1.56 C=C(C)c1ccc(c(c1)C=O)Cl 271570a_100000694244_100010254384 [0,2,0,0,0,0|2,0,0]=4 5738 B12R1.56 C=C(C)c1ccc(c(c1)C=O)F 271570a_100000694244_100000211465 [0,2,0,0,0,0|2,0,0]=4 5739 B12R1.56 C=C(C)c1ccc(c(c1)C=O)N 271570a_100000694244_100011935258 [0,2,0,0,0,0|2,0,0]=4 5740 B12R1.56 C=C(C)c1ccc(c(c1)C=O)O 271570a_100000694244_100000186750 [0,2,0,0,0,0|2,0,0]=4 5741 B12R1.56 C=C(C)c1ccc(c(c1)CC)Br 271570a_100000694244_100010244631 [0,2,0,0,0,0|2,0,0]=4 5742 B12R1.56 C=C(C)c1ccc(c(c1)CC)F 271570a_100000694244_100010244625 [0,2,0,0,0,0|2,0,0]=4 5743 B12R1.56 C=C(C)c1ccc(c(c1)CC)N 271570a_100000694244_100000686106 [0,2,0,0,0,0|2,0,0]=4 5744 B12R1.56 C=C(C)c1ccc(c(c1)CC)O 271570a_100000694244_100012338938 [0,2,0,0,0,0|2,0,0]=4 5745 B12R1.56 C=C(C)c1ccc(c(c1)CN)F 271570a_100000694244_100009815772 [0,2,0,0,0,0|2,0,0]=4 5746 B12R1.56 C=C(C)c1ccc(c(c1)CN)N 271570a_100000694244_100012349119 [0,2,0,0,0,0|2,0,0]=4 5747 B12R1.56 C=C(C)c1ccc(c(c1)CN)O 271570a_100000694244_100000730032 [0,2,0,0,0,0|2,0,0]=4 5748 B12R1.56 C=C(C)c1ccc(c(c1)CO)Br 271570a_100000694244_100012359683 [0,2,0,0,0,0|2,0,0]=4 5749 B12R1.56 C=C(C)c1ccc(c(c1)CO)C 271570a_100000694244_100000700630 [0,2,0,0,0,0|1,0,0]=3 5750 B12R1.56 C=C(C)c1ccc(c(c1)CO)Cl 271570a_100000694244_100010128486 [0,2,0,0,0,0|2,0,0]=4 5751 B12R1.56 C=C(C)c1ccc(c(c1)CO)F 271570a_100000694244_100000049604 [0,2,0,0,0,0|2,0,0]=4 5752 B12R1.56 C=C(C)c1ccc(c(c1)CO)N 271570a_100000694244_100012353972 [0,2,0,0,0,0|2,0,0]=4 5753 B12R1.56 C=C(C)c1ccc(c(c1)CO)O 271570a_100000694244_100000184703 [0,2,0,0,0,0|2,0,0]=4 5754 B12R1.56 C=C(C)c1ccc(c(c1)NC)C 271570a_100000694244_100020629602 [0,2,0,0,0,0|1,0,0]=3 5755 B12R1.56 C=C(C)c1ccc(c(c1)NC)F 271570a_100000694244_100011314990 [0,2,0,0,0,0|2,0,0]=4 5756 B12R1.56 C=C(C)c1ccc(c(c1)NC)N 271570a_100000694244_100000694363 [0,2,0,0,0,0|2,0,0]=4 5757 B12R1.56 C=C(C)c1ccc(c(c1)NN)F 271570a_100000694244_100020610843 [0,2,0,0,0,0|2,0,0]=4 5758 B12R1.56 C=C(C)c1ccc(c(c1)OC)Br 271570a_100000694244_100012353699 [0,2,0,0,0,0|2,0,0]=4 5759 B12R1.56 C=C(C)c1ccc(c(c1)OC)C 271570a_100000694244_100011830276 [0,2,0,0,0,0|1,0,0]=3 5760 B12R1.56 C=C(C)c1ccc(c(c1)OC)Cl 271570a_100000694244_100011356853 [0,2,0,0,0,0|2,0,0]=4 5761 B12R1.56 C=C(C)c1ccc(c(c1)OC)F 271570a_100000694244_100011934186 [0,2,0,0,0,0|2,0,0]=4 5762 B12R1.56 C=C(C)c1ccc(c(c1)OC)N 271570a_100000694244_100011279103 [0,2,0,0,0,0|2,0,0]=4 5763 B12R1.56 C=C(C)c1ccc(c(c1)OC)O 271570a_100000694244_100000694246 [0,2,0,0,0,0|2,0,0]=4 5764 B12R1.56 C=C(C)c1ccc(c(c1)SC)F 271570a_100000694244_100010341305 [0,2,0,0,0,0|2,0,0]=4 5765 B12R1.56 C=C(C)c1ccc(c(n1)C#N)C 271570a_100000694244_100000709982 [0,2,0,0,0,0|2,0,0]=4 5766 B12R1.56 C=C(C)c1cnc(c(c1)C#N)C 271570a_100000694244_200016216807 [0,2,0,0,0,0|2,0,0]=4 5767 B12R1.56 C=C(C)c1cnc(c(c1)CO)C 271570a_100000694244_100010894652 [0,2,0,0,0,0|2,0,0]=4 5768 B12R1.56 C=C(C)c1cnc(c(c1)OC)C 271570a_100000694244_100010254219 [0,2,0,0,0,0|2,0,0]=4 5769 B12R1.56 C=Cc1cc(ccc1Br)C(=O)C 271570a_100011290941_100010146556 [0,2,0,0,0,0|1,0,0]=3 5770 B12R1.56 C=Cc1cc(ccc1C)C(=O)C 271570a_100011290941_100011934287 [0,2,0,0,0,0|0,0,0]=2 5771 B12R1.56 C=Cc1cc(ccc1C)C(=O)N 271570a_100011290941_100000186401 [0,2,0,0,0,0|1,0,0]=3 5772 B12R1.56 C=Cc1cc(ccc1F)C(=O)C 271570a_100011290941_100000239719 [0,2,0,0,0,0|1,0,0]=3 5773 B12R1.56 C=Cc1cc(ccc1F)C(=O)N 271570a_100011290941_100011202321 [0,2,0,0,0,0|2,0,0]=4 5774 B12R1.56 C=Cc1cc(ccc1N)C(=O)C 271570a_100011290941_100012029215 [0,2,0,0,0,0|1,0,0]=3 5775 B12R1.56 C=Cc1cc(ccc1O)C(=O)C 271570a_100011290941_100011772453 [0,2,0,0,0,0|1,0,0]=3 5776 B12R1.56 C=Cc1cc(cnc1F)C(=O)C 271570a_100011290941_200010135287 [0,2,0,0,0,0|2,0,0]=4 5777 B12R1.56 CC(=O)c1ccc(c(c1)C#N)Br 1458a_100010253904_200000210301 [0,2,0,0,0,0|1,0,0]=3 5778 B12R1.56 CC(=O)c1ccc(c(c1)C#N)Cl 1458a_100000696165_200000210301 [0,2,0,0,0,0|1,0,0]=3 5779 B12R1.56 CC(=O)c1ccc(c(c1)C#N)F 1458a_100000697239_200000210301 [0,2,0,0,0,0|1,0,0]=3 5780 B12R1.56 CC(=O)c1ccc(c(c1)C#N)O 1458a_100009875055_200000210301 [0,2,0,0,0,0|1,0,0]=3 5781 B12R1.56 CC(=O)c1ccc(c(c1)C#N)O 271570a_203496583355_100010125495 [0,2,0,0,0,0|1,0,0]=3 5782 B12R1.56 CC(=O)c1ccc(c(c1)CO)Br 1458a_100010218026_200000210301 [0,2,0,0,0,0|1,0,0]=3 5783 B12R1.56 CC(=O)c1ccc(c(c1)CO)F 1458a_100011803322_200000210301 [0,2,0,0,0,0|1,0,0]=3 5784 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])C 34a_100000084092_200025704644 [0,2,0,0,0,0|0,0,0]=2 5785 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])C 7a_100000084092_200025704644 [0,2,0,0,0,0|0,0,0]=2 5786 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])F 34a_100000117923_200025704644 [0,2,0,0,0,0|1,0,0]=3 5787 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])F 7a_100000117923_200025704644 [0,2,0,0,0,0|1,0,0]=3 5788 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])Br 62a_100010146556_200025704644 [0,2,0,0,0,0|1,0,0]=3 5789 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])Br 62a_200025704644_100010146556 [0,2,0,0,0,0|1,0,0]=3 5790 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])C 62a_100011934287_200025704644 [0,2,0,0,0,0|0,0,0]=2 5791 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])C 62a_200025704644_100011934287 [0,2,0,0,0,0|0,0,0]=2 5792 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])F 62a_100000239719_200025704644 [0,2,0,0,0,0|1,0,0]=3 5793 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])F 62a_200025704644_100000239719 [0,2,0,0,0,0|1,0,0]=3 5794 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])N 62a_100012029215_200025704644 [0,2,0,0,0,0|1,0,0]=3 5795 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])O 62a_100011772453_200025704644 [0,2,0,0,0,0|1,0,0]=3 5796 B12R1.56 CC(=O)c1cnc(c(c1)S[13CH3])F 62a_200010135287_200025704644 [0,2,0,0,0,0|2,0,0]=4 5797 B12R1.56 CC(=O)c1cnc(c(c1)S[13CH3])F 62a_200025704644_200010135287 [0,2,0,0,0,0|2,0,0]=4 5798 B12R1.56 CCc1cc(ccc1Br)C(=O)C 1458a_100010152358_200000210301 [0,2,0,0,0,0|1,0,0]=3 5799 B12R1.56 CCc1cc(ccc1Br)C(=O)[13CH3] 1458a_100010152358_200025704644 [0,2,0,0,0,0|1,0,0]=3 5800 B12R1.56 CCc1cc(ccc1Cl)C(=O)C 1458a_100000102533_200000210301 [0,2,0,0,0,0|1,0,0]=3 5801 B12R1.56 CCc1cc(ccc1Cl)C(=O)[13CH3] 1458a_100000102533_200025704644 [0,2,0,0,0,0|1,0,0]=3 5802 B12R1.56 CCc1cc(ccc1F)C(=O)C 1458a_100009883079_200000210301 [0,2,0,0,0,0|1,0,0]=3 5803 B12R1.56 CCc1cc(ccc1F)C(=O)[13CH3] 1458a_100009883079_200025704644 [0,2,0,0,0,0|1,0,0]=3 5804 B12R1.56 CNc1cc(ccc1C)C(=O)N 34a_100000188646_200000210301 [0,2,0,0,0,0|1,0,0]=3 5805 B12R1.56 CNc1cc(ccc1C)C(=O)N 7a_100000188646_200000210301 [0,2,0,0,0,0|1,0,0]=3 5806 B12R1.56 CNc1cc(ccc1C)C(C)C 2230a_100011216979_200000210301 [0,2,0,0,0,0|1,0,1]=4 5807 B12R1.56 CNc1cc(ccc1C)C(C)C 34a_100011216979_200000210301 [0,2,0,0,0,0|1,0,1]=4 5808 B12R1.56 CNc1cc(ccc1C)C(C)C 7a_100011216979_200000210301 [0,2,0,0,0,0|1,0,1]=4 5809 B12R1.56 CNc1cc(ccc1C)N(C)C 34a_100015186894_200000210301 [0,2,0,0,0,0|2,0,0]=4 5810 B12R1.56 CNc1cc(ccc1C)[N+](=O)[O-] 34a_100000184112_200000210301 [0,2,0,0,0,0|2,0,0]=4 5811 B12R1.56 CNc1cc(ccc1C)[N+](=O)[O-] 7a_100000184112_200000210301 [0,2,0,0,0,0|2,0,0]=4 5812 B12R1.56 CNc1cc(ccc1Cl)C(=O)N 34a_100000736751_200000210301 [0,2,0,0,0,0|2,0,0]=4 5813 B12R1.56 CNc1cc(ccc1F)C(=O)N 34a_100000740466_200000210301 [0,2,0,0,0,0|2,0,0]=4 5814 B12R1.56 CNc1cc(cnc1F)C(=O)C 27a_100102657272_200010135287 [0,2,0,0,0,0|2,0,0]=4 5815 B12R1.56 COc1cc(ccc1Br)C(=O)C 1458a_100011934951_200000210301 [0,2,0,0,0,0|1,0,0]=3 5816 B12R1.56 COc1cc(ccc1Br)C(=O)N 34a_100012344895_200000210301 [0,2,0,0,0,0|2,0,0]=4 5817 B12R1.56 COc1cc(ccc1Br)C(=O)N 7a_100012344895_200000210301 [0,2,0,0,0,0|2,0,0]=4 5818 B12R1.56 COc1cc(ccc1Br)C(=O)[13CH3] 1458a_100011934951_200025704644 [0,2,0,0,0,0|1,0,0]=3 5819 B12R1.56 COc1cc(ccc1C)C(=O)C 1458a_100000212341_200000210301 [0,2,0,0,0,0|0,0,0]=2 5820 B12R1.56 COc1cc(ccc1C)C(=O)C 34a_100000084092_200000210301 [0,2,0,0,0,0|0,0,0]=2 5821 B12R1.56 COc1cc(ccc1C)C(=O)C 7a_100000084092_200000210301 [0,2,0,0,0,0|0,0,0]=2 5822 B12R1.56 COc1cc(ccc1C)C(=O)[13CH3] 1458a_100000212341_200025704644 [0,2,0,0,0,0|0,0,0]=2 5823 B12R1.56 COc1cc(ccc1C)C(C)C 34a_100000212073_200000210301 [0,2,0,0,0,0|1,0,1]=4 5824 B12R1.56 COc1cc(ccc1C)C(C)C 7a_100000212073_200000210301 [0,2,0,0,0,0|1,0,1]=4 5825 B12R1.56 COc1cc(ccc1C)[N+](=O)[O-] 34a_100000740739_200000210301 [0,2,0,0,0,0|2,0,0]=4 5826 B12R1.56 COc1cc(ccc1C)[N+](=O)[O-] 7a_100000740739_200000210301 [0,2,0,0,0,0|2,0,0]=4 5827 B12R1.56 COc1cc(ccc1Cl)C(=O)C 1458a_100000181799_200000210301 [0,2,0,0,0,0|1,0,0]=3 5828 B12R1.56 COc1cc(ccc1Cl)C(=O)[13CH3] 1458a_100000181799_200025704644 [0,2,0,0,0,0|1,0,0]=3 5829 B12R1.56 COc1cc(ccc1F)C(=O)C 1458a_100000757635_200000210301 [0,2,0,0,0,0|1,0,0]=3 5830 B12R1.56 COc1cc(ccc1F)C(=O)C 34a_100000117923_200000210301 [0,2,0,0,0,0|1,0,0]=3 5831 B12R1.56 COc1cc(ccc1F)C(=O)C 7a_100000117923_200000210301 [0,2,0,0,0,0|1,0,0]=3 5832 B12R1.56 COc1cc(ccc1F)C(=O)[13CH3] 1458a_100000757635_200025704644 [0,2,0,0,0,0|1,0,0]=3 5833 B12R1.56 COc1cc(ccc1I)C(=O)C 1458a_100012356290_200000210301 [0,2,0,0,0,0|1,0,0]=3 5834 B12R1.56 COc1cc(ccc1I)C(=O)[13CH3] 1458a_100012356290_200025704644 [0,2,0,0,0,0|1,0,0]=3 5835 B12R1.56 COc1cc(ccc1N)C(=O)N 34a_100011850428_200000210301 [0,2,0,0,0,0|2,0,0]=4 5836 B12R1.56 COc1cc(ccc1N)C(=O)N 7a_100011850428_200000210301 [0,2,0,0,0,0|2,0,0]=4 5837 B12R1.56 COc1cc(ccc1O)C(=O)C 1458a_100000687070_200000210301 [0,2,0,0,0,0|1,0,0]=3 5838 B12R1.56 COc1cc(ccc1O)C(=O)C 271570a_203496583355_100010110075 [0,2,0,0,0,0|1,0,0]=3 5839 B12R1.56 COc1cc(ccc1O)C(=O)N 271570a_203496583355_100009817049 [0,2,0,0,0,0|2,0,0]=4 5840 B12R1.56 COc1cc(ccc1O)C(=O)[13CH3] 1458a_100000687070_200025704644 [0,2,0,0,0,0|1,0,0]=3 5841 B12R1.56 CSc1cc(ccc1Br)C(=O)C 62a_100010146556_200000210301 [0,2,0,0,0,0|1,0,0]=3 5842 B12R1.56 CSc1cc(ccc1Br)C(=O)C 62a_200000210301_100010146556 [0,2,0,0,0,0|1,0,0]=3 5843 B12R1.56 CSc1cc(ccc1C)C(=O)C 62a_100011934287_200000210301 [0,2,0,0,0,0|0,0,0]=2 5844 B12R1.56 CSc1cc(ccc1C)C(=O)C 62a_200000210301_100011934287 [0,2,0,0,0,0|0,0,0]=2 5845 B12R1.56 CSc1cc(ccc1C)C(=O)N 62a_100000186401_200000210301 [0,2,0,0,0,0|1,0,0]=3 5846 B12R1.56 CSc1cc(ccc1C)C(=O)N 62a_200000210301_100000186401 [0,2,0,0,0,0|1,0,0]=3 5847 B12R1.56 CSc1cc(ccc1F)C(=O)C 62a_100000239719_200000210301 [0,2,0,0,0,0|1,0,0]=3 5848 B12R1.56 CSc1cc(ccc1F)C(=O)C 62a_200000210301_100000239719 [0,2,0,0,0,0|1,0,0]=3 5849 B12R1.56 CSc1cc(ccc1F)C(=O)N 62a_100011202321_200000210301 [0,2,0,0,0,0|2,0,0]=4 5850 B12R1.56 CSc1cc(ccc1F)C(=O)N 62a_200000210301_100011202321 [0,2,0,0,0,0|2,0,0]=4 5851 B12R1.56 CSc1cc(ccc1N)C(=O)C 62a_100012029215_200000210301 [0,2,0,0,0,0|1,0,0]=3 5852 B12R1.56 CSc1cc(ccc1O)C(=O)C 62a_100011772453_200000210301 [0,2,0,0,0,0|1,0,0]=3 5853 B12R1.56 CSc1cc(cnc1F)C(=O)C 62a_200000210301_200010135287 [0,2,0,0,0,0|2,0,0]=4 5854 B12R1.56 CSc1cc(cnc1F)C(=O)C 62a_200010135287_200000210301 [0,2,0,0,0,0|2,0,0]=4 5855 B12R1.56 Cc1ccc(cc1N[13CH3])C(=O)N 34a_100000188646_200025704644 [0,2,0,0,0,0|1,0,0]=3 5856 B12R1.56 Cc1ccc(cc1N[13CH3])C(=O)N 7a_100000188646_200025704644 [0,2,0,0,0,0|1,0,0]=3 5857 B12R1.56 Cc1ccc(cc1N[13CH3])C(C)C 2230a_100011216979_200025704644 [0,2,0,0,0,0|1,0,1]=4 5858 B12R1.56 Cc1ccc(cc1N[13CH3])C(C)C 34a_100011216979_200025704644 [0,2,0,0,0,0|1,0,1]=4 5859 B12R1.56 Cc1ccc(cc1N[13CH3])C(C)C 7a_100011216979_200025704644 [0,2,0,0,0,0|1,0,1]=4 5860 B12R1.56 Cc1ccc(cc1N[13CH3])N(C)C 34a_100015186894_200025704644 [0,2,0,0,0,0|2,0,0]=4 5861 B12R1.56 Cc1ccc(cc1N[13CH3])[N+](=O)[O-] 34a_100000184112_200025704644 [0,2,0,0,0,0|2,0,0]=4 5862 B12R1.56 Cc1ccc(cc1N[13CH3])[N+](=O)[O-] 7a_100000184112_200025704644 [0,2,0,0,0,0|2,0,0]=4 5863 B12R1.56 Cc1ccc(cc1O[13CH3])C(C)C 34a_100000212073_200025704644 [0,2,0,0,0,0|1,0,1]=4 5864 B12R1.56 Cc1ccc(cc1O[13CH3])C(C)C 7a_100000212073_200025704644 [0,2,0,0,0,0|1,0,1]=4 5865 B12R1.56 Cc1ccc(cc1O[13CH3])[N+](=O)[O-] 34a_100000740739_200025704644 [0,2,0,0,0,0|2,0,0]=4 5866 B12R1.56 Cc1ccc(cc1O[13CH3])[N+](=O)[O-] 7a_100000740739_200025704644 [0,2,0,0,0,0|2,0,0]=4 5867 B12R1.56 Cc1ccc(cc1S[13CH3])C(=O)N 62a_100000186401_200025704644 [0,2,0,0,0,0|1,0,0]=3 5868 B12R1.56 Cc1ccc(cc1S[13CH3])C(=O)N 62a_200025704644_100000186401 [0,2,0,0,0,0|1,0,0]=3 5869 B12R1.56 [13CH3]C(=O)c1ccc(c(c1)C#N)Br 1458a_100010253904_200025704644 [0,2,0,0,0,0|1,0,0]=3 5870 B12R1.56 [13CH3]C(=O)c1ccc(c(c1)C#N)Cl 1458a_100000696165_200025704644 [0,2,0,0,0,0|1,0,0]=3 5871 B12R1.56 [13CH3]C(=O)c1ccc(c(c1)C#N)F 1458a_100000697239_200025704644 [0,2,0,0,0,0|1,0,0]=3 5872 B12R1.56 [13CH3]C(=O)c1ccc(c(c1)C#N)O 1458a_100009875055_200025704644 [0,2,0,0,0,0|1,0,0]=3 5873 B12R1.56 [13CH3]C(=O)c1ccc(c(c1)CO)Br 1458a_100010218026_200025704644 [0,2,0,0,0,0|1,0,0]=3 5874 B12R1.56 [13CH3]C(=O)c1ccc(c(c1)CO)F 1458a_100011803322_200025704644 [0,2,0,0,0,0|1,0,0]=3 5875 B12R1.56 [13CH3]Nc1cc(ccc1Cl)C(=O)N 34a_100000736751_200025704644 [0,2,0,0,0,0|2,0,0]=4 5876 B12R1.56 [13CH3]Nc1cc(ccc1F)C(=O)N 34a_100000740466_200025704644 [0,2,0,0,0,0|2,0,0]=4 5877 B12R1.56 [13CH3]Oc1cc(ccc1Br)C(=O)N 34a_100012344895_200025704644 [0,2,0,0,0,0|2,0,0]=4 5878 B12R1.56 [13CH3]Oc1cc(ccc1Br)C(=O)N 7a_100012344895_200025704644 [0,2,0,0,0,0|2,0,0]=4 5879 B12R1.56 [13CH3]Oc1cc(ccc1N)C(=O)N 34a_100011850428_200025704644 [0,2,0,0,0,0|2,0,0]=4 5880 B12R1.56 [13CH3]Oc1cc(ccc1N)C(=O)N 7a_100011850428_200025704644 [0,2,0,0,0,0|2,0,0]=4 5881 B12R1.56 [13CH3]Sc1cc(ccc1F)C(=O)N 62a_100011202321_200025704644 [0,2,0,0,0,0|2,0,0]=4 5882 B12R1.56 [13CH3]Sc1cc(ccc1F)C(=O)N 62a_200025704644_100011202321 [0,2,0,0,0,0|2,0,0]=4 5883 B12R1.232 C=C(C)c1cc(c([nH]c1=O)C)C 271570a_100000694244_100010064231 [0,2,0,0,0,0|2,0,0]=4 5884 B12R1.232 C=C(C)c1cc(c(cc1Br)Br)Br 271570a_100000694244_100010151546 [0,2,0,0,0,0|2,0,0]=4 5885 B12R1.232 C=C(C)c1cc(c(cc1Br)Br)F 271570a_100000694244_200010212206 [0,2,0,0,0,0|2,0,0]=4 5886 B12R1.232 C=C(C)c1cc(c(cc1Br)C)Br 271570a_100000694244_100012929169 [0,2,0,0,0,0|1,0,0]=3 5887 B12R1.232 C=C(C)c1cc(c(cc1Br)C)F 271570a_100000694244_200009814774 [0,2,0,0,0,0|1,0,0]=3 5888 B12R1.232 C=C(C)c1cc(c(cc1Br)Cl)F 271570a_100000694244_100010254745 [0,2,0,0,0,0|2,0,0]=4 5889 B12R1.232 C=C(C)c1cc(c(cc1Br)Cl)O 271570a_100000694244_100021297947 [0,2,0,0,0,0|2,0,0]=4 5890 B12R1.232 C=C(C)c1cc(c(cc1Br)F)C 271570a_100000694244_200009814773 [0,2,0,0,0,0|2,0,0]=4 5891 B12R1.232 C=C(C)c1cc(c(cc1Br)F)F 271570a_100000694244_100010259568 [0,2,0,0,0,0|2,0,0]=4 5892 B12R1.232 C=C(C)c1cc(c(cc1C)Br)C 271570a_100000694244_100011356911 [0,2,0,0,0,0|2,0,0]=4 5893 B12R1.232 C=C(C)c1cc(c(cc1C)Br)Cl 271570a_100000694244_200009814780 [0,2,0,0,0,0|2,0,0]=4 5894 B12R1.232 C=C(C)c1cc(c(cc1C)Br)F 271570a_100000694244_100011356895 [0,2,0,0,0,0|2,0,0]=4 5895 B12R1.232 C=C(C)c1cc(c(cc1C)C)C 271570a_100000694244_100000759388 [0,2,0,0,0,0|1,0,0]=3 5896 B12R1.232 C=C(C)c1cc(c(cc1C)C)N 271570a_100000694244_100000703630 [0,2,0,0,0,0|1,0,0]=3 5897 B12R1.232 C=C(C)c1cc(c(cc1C)Cl)C 271570a_100000694244_100012357408 [0,2,0,0,0,0|2,0,0]=4 5898 B12R1.232 C=C(C)c1cc(c(cc1C)F)Br 271570a_100000694244_100011216669 [0,2,0,0,0,0|2,0,0]=4 5899 B12R1.232 C=C(C)c1cc(c(cc1C)F)C 271570a_100000694244_100010212296 [0,2,0,0,0,0|2,0,0]=4 5900 B12R1.232 C=C(C)c1cc(c(cc1C)F)F 271570a_100000694244_100009815990 [0,2,0,0,0,0|2,0,0]=4 5901 B12R1.232 C=C(C)c1cc(c(cc1C)F)N 271570a_100000694244_100011014115 [0,2,0,0,0,0|2,0,0]=4 5902 B12R1.232 C=C(C)c1cc(c(cc1C)F)O 271570a_100000694244_100010068922 [0,2,0,0,0,0|2,0,0]=4 5903 B12R1.232 C=C(C)c1cc(c(cc1C)N)C 271570a_100000694244_100011934712 [0,2,0,0,0,0|2,0,0]=4 5904 B12R1.232 C=C(C)c1cc(c(cc1C)N)F 271570a_100000694244_100000691575 [0,2,0,0,0,0|2,0,0]=4 5905 B12R1.232 C=C(C)c1cc(c(cc1C)N)N 271570a_100000694244_100010080480 [0,2,0,0,0,0|2,0,0]=4 5906 B12R1.232 C=C(C)c1cc(c(cc1C)N)O 271570a_100000694244_200010107346 [0,2,0,0,0,0|2,0,0]=4 5907 B12R1.232 C=C(C)c1cc(c(cc1C)O)C 271570a_100000694244_100000698207 [0,2,0,0,0,0|2,0,0]=4 5908 B12R1.232 C=C(C)c1cc(c(cc1C)O)F 271570a_100000694244_100012355673 [0,2,0,0,0,0|2,0,0]=4 5909 B12R1.232 C=C(C)c1cc(c(cc1C)O)N 271570a_100000694244_200010235796 [0,2,0,0,0,0|2,0,0]=4 5910 B12R1.232 C=C(C)c1cc(c(cc1Cl)Br)C 271570a_100000694244_100010259621 [0,2,0,0,0,0|2,0,0]=4 5911 B12R1.232 C=C(C)c1cc(c(cc1Cl)Br)Cl 271570a_100000694244_200010244590 [0,2,0,0,0,0|2,0,0]=4 5912 B12R1.232 C=C(C)c1cc(c(cc1Cl)Br)F 271570a_100000694244_100010212230 [0,2,0,0,0,0|2,0,0]=4 5913 B12R1.232 C=C(C)c1cc(c(cc1Cl)Cl)Cl 271570a_100000694244_200011216203 [0,2,0,0,0,0|2,0,0]=4 5914 B12R1.232 C=C(C)c1cc(c(cc1Cl)Cl)N 271570a_100000694244_100016224655 [0,2,0,0,0,0|2,0,0]=4 5915 B12R1.232 C=C(C)c1cc(c(cc1Cl)F)F 271570a_100000694244_100012349977 [0,2,0,0,0,0|2,0,0]=4 5916 B12R1.232 C=C(C)c1cc(c(cc1Cl)O)N 271570a_100000694244_100011011175 [0,2,0,0,0,0|2,0,0]=4 5917 B12R1.232 C=C(C)c1cc(c(cc1F)Br)Br 271570a_100000694244_200010212210 [0,2,0,0,0,0|2,0,0]=4 5918 B12R1.232 C=C(C)c1cc(c(cc1F)Br)C 271570a_100000694244_200009814772 [0,2,0,0,0,0|2,0,0]=4 5919 B12R1.232 C=C(C)c1cc(c(cc1F)Br)F 271570a_100000694244_100011356857 [0,2,0,0,0,0|2,0,0]=4 5920 B12R1.232 C=C(C)c1cc(c(cc1F)C)Br 271570a_100000694244_100011068846 [0,2,0,0,0,0|1,0,0]=3 5921 B12R1.232 C=C(C)c1cc(c(cc1F)C)C 271570a_100000694244_100010197417 [0,2,0,0,0,0|1,0,0]=3 5922 B12R1.232 C=C(C)c1cc(c(cc1F)C)F 271570a_100000694244_100011219510 [0,2,0,0,0,0|1,0,0]=3 5923 B12R1.232 C=C(C)c1cc(c(cc1F)C)N 271570a_100000694244_100000717900 [0,2,0,0,0,0|1,0,0]=3 5924 B12R1.232 C=C(C)c1cc(c(cc1F)C)O 271570a_100000694244_100014242602 [0,2,0,0,0,0|1,0,0]=3 5925 B12R1.232 C=C(C)c1cc(c(cc1F)Cl)F 271570a_100000694244_100010142863 [0,2,0,0,0,0|2,0,0]=4 5926 B12R1.232 C=C(C)c1cc(c(cc1F)Cl)O 271570a_100000694244_100010735246 [0,2,0,0,0,0|2,0,0]=4 5927 B12R1.232 C=C(C)c1cc(c(cc1F)F)Br 271570a_100000694244_100011356914 [0,2,0,0,0,0|2,0,0]=4 5928 B12R1.232 C=C(C)c1cc(c(cc1F)F)C 271570a_100000694244_100000692463 [0,2,0,0,0,0|2,0,0]=4 5929 B12R1.232 C=C(C)c1cc(c(cc1F)F)F 271570a_100000694244_100000686897 [0,2,0,0,0,0|2,0,0]=4 5930 B12R1.232 C=C(C)c1cc(c(cc1F)F)N 271570a_100000694244_100000700208 [0,2,0,0,0,0|2,0,0]=4 5931 B12R1.232 C=C(C)c1cc(c(cc1F)F)O 271570a_100000694244_100012457948 [0,2,0,0,0,0|2,0,0]=4 5932 B12R1.232 C=C(C)c1cc(c(cc1F)N)C 271570a_100000694244_100000695870 [0,2,0,0,0,0|2,0,0]=4 5933 B12R1.232 C=C(C)c1cc(c(cc1F)N)F 271570a_100000694244_100000690247 [0,2,0,0,0,0|2,0,0]=4 5934 B12R1.232 C=C(C)c1cc(c(cc1F)N)N 271570a_100000694244_100000766667 [0,2,0,0,0,0|2,0,0]=4 5935 B12R1.232 C=C(C)c1cc(c(cc1F)N)O 271570a_100000694244_100013038943 [0,2,0,0,0,0|2,0,0]=4 5936 B12R1.232 C=C(C)c1cc(c(cc1F)O)F 271570a_100000694244_100011830439 [0,2,0,0,0,0|2,0,0]=4 5937 B12R1.232 C=C(C)c1cc(c(cc1F)O)N 271570a_100000694244_100012359894 [0,2,0,0,0,0|2,0,0]=4 5938 B12R1.232 C=C(C)c1cc(c(cc1N)Br)C 271570a_100000694244_200015600912 [0,2,0,0,0,0|2,0,0]=4 5939 B12R1.232 C=C(C)c1cc(c(cc1N)Br)F 271570a_100000694244_200021016574 [0,2,0,0,0,0|2,0,0]=4 5940 B12R1.232 C=C(C)c1cc(c(cc1N)C)C 271570a_100000694244_100012337760 [0,2,0,0,0,0|1,0,0]=3 5941 B12R1.232 C=C(C)c1cc(c(cc1N)C)F 271570a_100000694244_100010233353 [0,2,0,0,0,0|1,0,0]=3 5942 B12R1.232 C=C(C)c1cc(c(cc1N)Cl)Cl 271570a_100000694244_200011093942 [0,2,0,0,0,0|2,0,0]=4 5943 B12R1.232 C=C(C)c1cc(c(cc1N)Cl)F 271570a_100000694244_200010992381 [0,2,0,0,0,0|2,0,0]=4 5944 B12R1.232 C=C(C)c1cc(c(cc1N)F)Br 271570a_100000694244_100010888672 [0,2,0,0,0,0|2,0,0]=4 5945 B12R1.232 C=C(C)c1cc(c(cc1N)F)C 271570a_100000694244_100011218008 [0,2,0,0,0,0|2,0,0]=4 5946 B12R1.232 C=C(C)c1cc(c(cc1N)F)Cl 271570a_100000694244_100010892166 [0,2,0,0,0,0|2,0,0]=4 5947 B12R1.232 C=C(C)c1cc(c(cc1N)F)F 271570a_100000694244_100000765032 [0,2,0,0,0,0|2,0,0]=4 5948 B12R1.232 C=C(C)c1cc(c(cc1N)N)C 271570a_100000694244_200013038441 [0,2,0,0,0,0|2,0,0]=4 5949 B12R1.232 C=C(C)c1cc(c(cc1N)N)F 271570a_100000694244_200010115645 [0,2,0,0,0,0|2,0,0]=4 5950 B12R1.232 C=C(C)c1cc(c(cc1O)C)C 271570a_100000694244_100009814663 [0,2,0,0,0,0|1,0,0]=3 5951 B12R1.232 C=C(C)c1cc(c(cc1O)F)F 271570a_100000694244_100009813768 [0,2,0,0,0,0|2,0,0]=4 5952 B12R1.232 C=C(C)c1cc(c(nc1N)C)Br 271570a_100000694244_100000684678 [0,2,0,0,0,0|2,0,0]=4 5953 B12R1.232 C=C(C)c1cc(c(nc1N)C)C 271570a_100000694244_100009990238 [0,2,0,0,0,0|2,0,0]=4 5954 B12R1.232 C=C(C)c1nc(c(cc1N)C)F 271570a_100000694244_100010134903 [0,2,0,0,0,0|2,0,0]=4 5955 B12R1.232 CC(=O)c1cc(c(cc1Br)C)F 1458a_200012355688_200000210301 [0,2,0,0,0,0|0,0,0]=2 5956 B12R1.232 CC(=O)c1cc(c(cc1Br)F)C 1458a_100010204433_200000210301 [0,2,0,0,0,0|1,0,0]=3 5957 B12R1.232 CC(=O)c1cc(c(cc1Br)F)Cl 1458a_100012921620_200000210301 [0,2,0,0,0,0|1,0,0]=3 5958 B12R1.232 CC(=O)c1cc(c(cc1Br)F)F 1458a_100000685074_200000210301 [0,2,0,0,0,0|1,0,0]=3 5959 B12R1.232 CC(=O)c1cc(c(cc1C)Br)C 1458a_100000695896_200000210301 [0,2,0,0,0,0|1,0,0]=3 5960 B12R1.232 CC(=O)c1cc(c(cc1C)Br)F 1458a_100012344525_200000210301 [0,2,0,0,0,0|1,0,0]=3 5961 B12R1.232 CC(=O)c1cc(c(cc1C)C)Br 1458a_100012920494_200000210301 [0,2,0,0,0,0|0,0,0]=2 5962 B12R1.232 CC(=O)c1cc(c(cc1C)C)C 1458a_100011216168_200000210301 [0,2,0,0,0,0|0,0,0]=2 5963 B12R1.232 CC(=O)c1cc(c(cc1C)C)I 1458a_100000723791_200000210301 [0,2,0,0,0,0|0,0,0]=2 5964 B12R1.232 CC(=O)c1cc(c(cc1C)Cl)Cl 1458a_100010439669_200000210301 [0,2,0,0,0,0|1,0,0]=3 5965 B12R1.232 CC(=O)c1cc(c(cc1C)Cl)F 1458a_200010768543_200000210301 [0,2,0,0,0,0|1,0,0]=3 5966 B12R1.232 CC(=O)c1cc(c(cc1C)F)Br 1458a_100000724332_200000210301 [0,2,0,0,0,0|1,0,0]=3 5967 B12R1.232 CC(=O)c1cc(c(cc1C)F)F 1458a_100000062099_200000210301 [0,2,0,0,0,0|1,0,0]=3 5968 B12R1.232 CC(=O)c1cc(c(cc1C)F)I 1458a_100013328184_200000210301 [0,2,0,0,0,0|1,0,0]=3 5969 B12R1.232 CC(=O)c1cc(c(cc1Cl)Br)Cl 1458a_100000246132_200000210301 [0,2,0,0,0,0|1,0,0]=3 5970 B12R1.232 CC(=O)c1cc(c(cc1Cl)Br)F 1458a_100000724438_200000210301 [0,2,0,0,0,0|1,0,0]=3 5971 B12R1.232 CC(=O)c1cc(c(cc1Cl)C)Cl 1458a_100013033594_200000210301 [0,2,0,0,0,0|0,0,0]=2 5972 B12R1.232 CC(=O)c1cc(c(cc1Cl)C)F 1458a_100009857485_200000210301 [0,2,0,0,0,0|0,0,0]=2 5973 B12R1.232 CC(=O)c1cc(c(cc1Cl)Cl)Cl 1458a_100011934218_200000210301 [0,2,0,0,0,0|1,0,0]=3 5974 B12R1.232 CC(=O)c1cc(c(cc1Cl)Cl)F 1458a_100000212284_200000210301 [0,2,0,0,0,0|1,0,0]=3 5975 B12R1.232 CC(=O)c1cc(c(cc1Cl)F)C 1458a_100000687843_200000210301 [0,2,0,0,0,0|1,0,0]=3 5976 B12R1.232 CC(=O)c1cc(c(cc1Cl)F)F 1458a_100025704182_200000210301 [0,2,0,0,0,0|1,0,0]=3 5977 B12R1.232 CC(=O)c1cc(c(cc1Cl)F)I 1458a_100012920486_200000210301 [0,2,0,0,0,0|1,0,0]=3 5978 B12R1.232 CC(=O)c1cc(c(cc1F)Br)Br 1458a_200011217225_200000210301 [0,2,0,0,0,0|1,0,0]=3 5979 B12R1.232 CC(=O)c1cc(c(cc1F)Br)C 1458a_100012354683_200000210301 [0,2,0,0,0,0|1,0,0]=3 5980 B12R1.232 CC(=O)c1cc(c(cc1F)Br)Cl 1458a_100012347732_200000210301 [0,2,0,0,0,0|1,0,0]=3 5981 B12R1.232 CC(=O)c1cc(c(cc1F)Br)F 1458a_100012024349_200000210301 [0,2,0,0,0,0|1,0,0]=3 5982 B12R1.232 CC(=O)c1cc(c(cc1F)C)Br 1458a_100012920545_200000210301 [0,2,0,0,0,0|0,0,0]=2 5983 B12R1.232 CC(=O)c1cc(c(cc1F)C)Cl 1458a_100012180961_200000210301 [0,2,0,0,0,0|0,0,0]=2 5984 B12R1.232 CC(=O)c1cc(c(cc1F)C)F 1458a_100000686409_200000210301 [0,2,0,0,0,0|0,0,0]=2 5985 B12R1.232 CC(=O)c1cc(c(cc1F)C)O 1458a_100009839767_200000210301 [0,2,0,0,0,0|0,0,0]=2 5986 B12R1.232 CC(=O)c1cc(c(cc1F)Cl)Br 1458a_100011217226_200000210301 [0,2,0,0,0,0|1,0,0]=3 5987 B12R1.232 CC(=O)c1cc(c(cc1F)Cl)Cl 1458a_100011217469_200000210301 [0,2,0,0,0,0|1,0,0]=3 5988 B12R1.232 CC(=O)c1cc(c(cc1F)Cl)F 1458a_100000690020_200000210301 [0,2,0,0,0,0|1,0,0]=3 5989 B12R1.232 CC(=O)c1cc(c(cc1F)Cl)I 1458a_100012920488_200000210301 [0,2,0,0,0,0|1,0,0]=3 5990 B12R1.232 CC(=O)c1cc(c(cc1F)F)Br 1458a_100000718434_200000210301 [0,2,0,0,0,0|1,0,0]=3 5991 B12R1.232 CC(=O)c1cc(c(cc1F)F)C 1458a_100000767126_200000210301 [0,2,0,0,0,0|1,0,0]=3 5992 B12R1.232 CC(=O)c1cc(c(cc1F)F)Cl 1458a_100011997751_200000210301 [0,2,0,0,0,0|1,0,0]=3 5993 B12R1.232 CC(=O)c1cc(c(cc1F)F)F 1458a_100000687535_200000210301 [0,2,0,0,0,0|1,0,0]=3 5994 B12R1.232 CC(=O)c1cc(c(cc1F)F)I 1458a_100000691139_200000210301 [0,2,0,0,0,0|1,0,0]=3 5995 B12R1.232 CC(=O)c1cc(c(cc1F)F)O 271570a_203496583355_100009817148 [0,2,0,0,0,0|1,0,0]=3 5996 B12R1.232 CC(=O)c1cc(c(cc1F)O)Cl 1458a_200009924051_200000210301 [0,2,0,0,0,0|1,0,0]=3 5997 B12R1.232 CC(=O)c1cc(c(cc1F)O)F 271570a_203496583355_100012024335 [0,2,0,0,0,0|1,0,0]=3 5998 B12R1.232 CC(=O)c1cc(c(cc1I)C)C 1458a_100010184404_200000210301 [0,2,0,0,0,0|0,0,0]=2 5999 B12R1.232 CC(=O)c1cc(c(cc1I)F)F 1458a_100000688017_200000210301 [0,2,0,0,0,0|1,0,0]=3 6000 B12R1.232 CC(=O)c1cc(c(cc1O)Br)F 1458a_100010827371_200000210301 [0,2,0,0,0,0|1,0,0]=3 6001 B12R1.232 CC(=O)c1cc(c(cc1O)C)Br 1458a_100010233826_200000210301 [0,2,0,0,0,0|0,0,0]=2 6002 B12R1.232 CC(=O)c1cc(c(cc1O)C)C 1458a_100009831561_200000210301 [0,2,0,0,0,0|0,0,0]=2 6003 B12R1.232 CC(=O)c1cc(c(cc1O)C)O 271570a_203496583355_200010233951 [0,2,0,0,0,0|0,0,0]=2 6004 B12R1.232 CC(=O)c1cc(c(cc1O)Cl)Br 1458a_200009814723_200000210301 [0,2,0,0,0,0|1,0,0]=3 6005 B12R1.232 CC(=O)c1cc(c(cc1O)F)Br 1458a_100010188153_200000210301 [0,2,0,0,0,0|1,0,0]=3 6006 B12R1.232 CC(=O)c1cc(c(cc1O)F)Cl 1458a_100009910333_200000210301 [0,2,0,0,0,0|1,0,0]=3 6007 B12R1.232 CC(=O)c1cc(c(cc1O)F)F 1458a_100012182723_200000210301 [0,2,0,0,0,0|1,0,0]=3 6008 B12R1.232 CC(=O)c1cc(c(cc1O)F)F 271570a_203496583355_100013243444 [0,2,0,0,0,0|1,0,0]=3 6009 B12R1.232 CC(=O)c1cc(c(cc1O)F)O 271570a_203496583355_100000691652 [0,2,0,0,0,0|1,0,0]=3 6010 B12R1.232 CC(=O)c1cc(c(cc1O)O)Br 1458a_100009813906_200000210301 [0,2,0,0,0,0|1,0,0]=3 6011 B12R1.232 CC(=O)c1cc(c(cc1O)O)C 271570a_203496583355_100009816031 [0,2,0,0,0,0|1,0,0]=3 6012 B12R1.232 CC(=O)c1cc(c(cc1O)O)F 271570a_203496583355_200010245088 [0,2,0,0,0,0|1,0,0]=3 6013 B12R1.232 Cc1cc(c(cc1Br)C(=O)[13CH3])C 1458a_100012920494_200025704644 [0,2,0,0,0,0|0,0,0]=2 6014 B12R1.232 Cc1cc(c(cc1Br)C(=O)[13CH3])F 1458a_100012920545_200025704644 [0,2,0,0,0,0|0,0,0]=2 6015 B12R1.232 Cc1cc(c(cc1Br)C(=O)[13CH3])O 1458a_100010233826_200025704644 [0,2,0,0,0,0|0,0,0]=2 6016 B12R1.232 Cc1cc(c(cc1Br)C)C(=O)[13CH3] 1458a_100000695896_200025704644 [0,2,0,0,0,0|1,0,0]=3 6017 B12R1.232 Cc1cc(c(cc1Br)F)C(=O)[13CH3] 1458a_100012354683_200025704644 [0,2,0,0,0,0|1,0,0]=3 6018 B12R1.232 Cc1cc(c(cc1C(=O)[13CH3])Br)F 1458a_100000724332_200025704644 [0,2,0,0,0,0|1,0,0]=3 6019 B12R1.232 Cc1cc(c(cc1C(=O)[13CH3])Cl)Cl 1458a_100010439669_200025704644 [0,2,0,0,0,0|1,0,0]=3 6020 B12R1.232 Cc1cc(c(cc1C(=O)[13CH3])F)Br 1458a_100012344525_200025704644 [0,2,0,0,0,0|1,0,0]=3 6021 B12R1.232 Cc1cc(c(cc1C(=O)[13CH3])F)Cl 1458a_200010768543_200025704644 [0,2,0,0,0,0|1,0,0]=3 6022 B12R1.232 Cc1cc(c(cc1C(=O)[13CH3])F)F 1458a_100000062099_200025704644 [0,2,0,0,0,0|1,0,0]=3 6023 B12R1.232 Cc1cc(c(cc1C(=O)[13CH3])I)F 1458a_100013328184_200025704644 [0,2,0,0,0,0|1,0,0]=3 6024 B12R1.232 Cc1cc(c(cc1C)C(=O)[13CH3])C 1458a_100011216168_200025704644 [0,2,0,0,0,0|0,0,0]=2 6025 B12R1.232 Cc1cc(c(cc1C)C(=O)[13CH3])I 1458a_100010184404_200025704644 [0,2,0,0,0,0|0,0,0]=2 6026 B12R1.232 Cc1cc(c(cc1C)C(=O)[13CH3])O 1458a_100009831561_200025704644 [0,2,0,0,0,0|0,0,0]=2 6027 B12R1.232 Cc1cc(c(cc1Cl)C(=O)[13CH3])Cl 1458a_100013033594_200025704644 [0,2,0,0,0,0|0,0,0]=2 6028 B12R1.232 Cc1cc(c(cc1Cl)C(=O)[13CH3])F 1458a_100012180961_200025704644 [0,2,0,0,0,0|0,0,0]=2 6029 B12R1.232 Cc1cc(c(cc1F)Br)C(=O)[13CH3] 1458a_100010204433_200025704644 [0,2,0,0,0,0|1,0,0]=3 6030 B12R1.232 Cc1cc(c(cc1F)C(=O)[13CH3])Br 1458a_200012355688_200025704644 [0,2,0,0,0,0|0,0,0]=2 6031 B12R1.232 Cc1cc(c(cc1F)C(=O)[13CH3])Cl 1458a_100009857485_200025704644 [0,2,0,0,0,0|0,0,0]=2 6032 B12R1.232 Cc1cc(c(cc1F)C(=O)[13CH3])F 1458a_100000686409_200025704644 [0,2,0,0,0,0|0,0,0]=2 6033 B12R1.232 Cc1cc(c(cc1F)Cl)C(=O)[13CH3] 1458a_100000687843_200025704644 [0,2,0,0,0,0|1,0,0]=3 6034 B12R1.232 Cc1cc(c(cc1F)F)C(=O)[13CH3] 1458a_100000767126_200025704644 [0,2,0,0,0,0|1,0,0]=3 6035 B12R1.232 Cc1cc(c(cc1I)C(=O)[13CH3])C 1458a_100000723791_200025704644 [0,2,0,0,0,0|0,0,0]=2 6036 B12R1.232 Cc1cc(c(cc1O)C(=O)[13CH3])F 1458a_100009839767_200025704644 [0,2,0,0,0,0|0,0,0]=2 6037 B12R1.232 NC(=O)c1cc(c(cc1F)F)O 271570a_203496583355_100015235948 [0,2,0,0,0,0|2,0,0]=4 6038 B12R1.232 NC(=O)c1cc(c(cc1F)O)F 271570a_203496583355_100010244962 [0,2,0,0,0,0|2,0,0]=4 6039 B12R1.232 NC(=O)c1cc(c(cc1N)F)O 271570a_203496583355_100015444839 [0,2,0,0,0,0|2,0,0]=4 6040 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Br)F)Cl 1458a_100012921620_200025704644 [0,2,0,0,0,0|1,0,0]=3 6041 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Br)F)F 1458a_100000685074_200025704644 [0,2,0,0,0,0|1,0,0]=3 6042 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Cl)Br)Cl 1458a_100000246132_200025704644 [0,2,0,0,0,0|1,0,0]=3 6043 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Cl)Br)F 1458a_100000724438_200025704644 [0,2,0,0,0,0|1,0,0]=3 6044 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Cl)Cl)Cl 1458a_100011934218_200025704644 [0,2,0,0,0,0|1,0,0]=3 6045 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Cl)Cl)F 1458a_100000212284_200025704644 [0,2,0,0,0,0|1,0,0]=3 6046 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Cl)F)F 1458a_100025704182_200025704644 [0,2,0,0,0,0|1,0,0]=3 6047 B12R1.232 [13CH3]C(=O)c1cc(c(cc1Cl)F)I 1458a_100012920486_200025704644 [0,2,0,0,0,0|1,0,0]=3 6048 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Br)Br 1458a_200011217225_200025704644 [0,2,0,0,0,0|1,0,0]=3 6049 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Br)Cl 1458a_100012347732_200025704644 [0,2,0,0,0,0|1,0,0]=3 6050 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Br)F 1458a_100012024349_200025704644 [0,2,0,0,0,0|1,0,0]=3 6051 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Cl)Br 1458a_100011217226_200025704644 [0,2,0,0,0,0|1,0,0]=3 6052 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Cl)Cl 1458a_100011217469_200025704644 [0,2,0,0,0,0|1,0,0]=3 6053 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Cl)F 1458a_100000690020_200025704644 [0,2,0,0,0,0|1,0,0]=3 6054 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)Cl)I 1458a_100012920488_200025704644 [0,2,0,0,0,0|1,0,0]=3 6055 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)F)Br 1458a_100000718434_200025704644 [0,2,0,0,0,0|1,0,0]=3 6056 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)F)Cl 1458a_100011997751_200025704644 [0,2,0,0,0,0|1,0,0]=3 6057 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)F)F 1458a_100000687535_200025704644 [0,2,0,0,0,0|1,0,0]=3 6058 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)F)I 1458a_100000691139_200025704644 [0,2,0,0,0,0|1,0,0]=3 6059 B12R1.232 [13CH3]C(=O)c1cc(c(cc1F)O)Cl 1458a_200009924051_200025704644 [0,2,0,0,0,0|1,0,0]=3 6060 B12R1.232 [13CH3]C(=O)c1cc(c(cc1I)F)F 1458a_100000688017_200025704644 [0,2,0,0,0,0|1,0,0]=3 6061 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)Br)F 1458a_100010827371_200025704644 [0,2,0,0,0,0|1,0,0]=3 6062 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)Cl)Br 1458a_200009814723_200025704644 [0,2,0,0,0,0|1,0,0]=3 6063 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)F)Br 1458a_100010188153_200025704644 [0,2,0,0,0,0|1,0,0]=3 6064 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)F)Cl 1458a_100009910333_200025704644 [0,2,0,0,0,0|1,0,0]=3 6065 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)F)F 1458a_100012182723_200025704644 [0,2,0,0,0,0|1,0,0]=3 6066 B12R1.232 [13CH3]C(=O)c1cc(c(cc1O)O)Br 1458a_100009813906_200025704644 [0,2,0,0,0,0|1,0,0]=3 6067 B12R1.367 CCC(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_100000210202 [0,2,0,0,0,0|1,0,0]=3 6068 B12R1.367 CCC(=O)c1ccc(c(c1)Br)C 1458a_100000186397_100000210202 [0,2,0,0,0,0|0,0,0]=2 6069 B12R1.367 CCC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_100000210202 [0,2,0,0,0,0|1,0,0]=3 6070 B12R1.367 CCC(=O)c1ccc(c(c1)Br)F 1458a_100000760357_100000210202 [0,2,0,0,0,0|1,0,0]=3 6071 B12R1.367 CCC(=O)c1ccc(c(c1)Br)I 1458a_100000739115_100000210202 [0,2,0,0,0,0|1,0,0]=3 6072 B12R1.367 CCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000210202 [0,2,0,0,0,0|1,0,0]=3 6073 B12R1.367 CCC(=O)c1ccc(c(c1)C)Br 1458a_100000692631_100000210202 [0,2,0,0,0,0|1,0,0]=3 6074 B12R1.367 CCC(=O)c1ccc(c(c1)C)C 1458a_100000210898_100000210202 [0,2,0,0,0,0|0,0,0]=2 6075 B12R1.367 CCC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_100000210202 [0,2,0,0,0,0|1,0,0]=3 6076 B12R1.367 CCC(=O)c1ccc(c(c1)C)F 1458a_100000751819_100000210202 [0,2,0,0,0,0|1,0,0]=3 6077 B12R1.367 CCC(=O)c1ccc(c(c1)C)I 1458a_100000751300_100000210202 [0,2,0,0,0,0|1,0,0]=3 6078 B12R1.367 CCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000210202 [0,2,0,0,0,0|1,0,0]=3 6079 B12R1.367 CCC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200012349626 [0,2,0,0,0,0|1,0,0]=3 6080 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_100000210202 [0,2,0,0,0,0|1,0,0]=3 6081 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)C 1458a_100000751740_100000210202 [0,2,0,0,0,0|0,0,0]=2 6082 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100000210202 [0,2,0,0,0,0|1,0,0]=3 6083 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_100000210202 [0,2,0,0,0,0|1,0,0]=3 6084 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_100000210202 [0,2,0,0,0,0|1,0,0]=3 6085 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000210202 [0,2,0,0,0,0|1,0,0]=3 6086 B12R1.367 CCC(=O)c1ccc(c(c1)F)Br 1458a_100000743946_100000210202 [0,2,0,0,0,0|1,0,0]=3 6087 B12R1.367 CCC(=O)c1ccc(c(c1)F)C 1458a_100000212313_100000210202 [0,2,0,0,0,0|0,0,0]=2 6088 B12R1.367 CCC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_100000210202 [0,2,0,0,0,0|1,0,0]=3 6089 B12R1.367 CCC(=O)c1ccc(c(c1)F)F 1458a_100000209822_100000210202 [0,2,0,0,0,0|1,0,0]=3 6090 B12R1.367 CCC(=O)c1ccc(c(c1)F)I 1458a_100000062624_100000210202 [0,2,0,0,0,0|1,0,0]=3 6091 B12R1.367 CCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000210202 [0,2,0,0,0,0|1,0,0]=3 6092 B12R1.367 CCC(=O)c1ccc(c(c1)I)Br 1458a_100012343876_100000210202 [0,2,0,0,0,0|1,0,0]=3 6093 B12R1.367 CCC(=O)c1ccc(c(c1)I)C 1458a_100000751299_100000210202 [0,2,0,0,0,0|0,0,0]=2 6094 B12R1.367 CCC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_100000210202 [0,2,0,0,0,0|1,0,0]=3 6095 B12R1.367 CCC(=O)c1ccc(c(c1)I)F 1458a_100000688015_100000210202 [0,2,0,0,0,0|1,0,0]=3 6096 B12R1.367 CCC(=O)c1ccc(c(c1)I)I 1458a_100000725830_100000210202 [0,2,0,0,0,0|1,0,0]=3 6097 B12R1.367 CCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000210202 [0,2,0,0,0,0|1,0,0]=3 6098 B12R1.367 CCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000210202 [0,2,0,0,0,0|1,0,0]=3 6099 B12R1.367 CCC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000210202 [0,2,0,0,0,0|0,0,0]=2 6100 B12R1.367 CCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210202 [0,2,0,0,0,0|1,0,0]=3 6101 B12R1.367 CCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000210202 [0,2,0,0,0,0|1,0,0]=3 6102 B12R1.367 CCC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100011216493 [0,2,0,0,0,0|1,0,0]=3 6103 B12R1.367 CCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000210202 [0,2,0,0,0,0|1,0,0]=3 6104 B12R1.367 CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210202 [0,2,0,0,0,0|1,0,0]=3 6105 B12R1.367 CCN(C)c1ccc(c(c1)Br)C 2230a_100000707694_100000210202 [0,2,0,0,0,0|2,0,0]=4 6106 B12R1.367 CCN(C)c1ccc(c(c1)Br)C 269982a_100000707694_100000204670 [0,2,0,0,0,0|2,0,0]=4 6107 B12R1.367 CCN(C)c1ccc(c(c1)Br)C 34a_100000707694_100000210202 [0,2,0,0,0,0|2,0,0]=4 6108 B12R1.367 CCN(C)c1ccc(c(c1)Br)C 38a_100000707694_100000204670 [0,2,0,0,0,0|2,0,0]=4 6109 B12R1.367 CCN(C)c1ccc(c(c1)C)C 2230a_106256033975_200000210301 [0,2,0,0,0,0|2,0,0]=4 6110 B12R1.367 CCN(C)c1ccc(c(c1)C)C 269982a_106256033975_200000210301 [0,2,0,0,0,0|2,0,0]=4 6111 B12R1.367 CCN(C)c1ccc(c(c1)C)C 34a_106256033975_200000210301 [0,2,0,0,0,0|2,0,0]=4 6112 B12R1.367 CCN(C)c1ccc(c(c1)C)C 7a_106256033975_200000210301 [0,2,0,0,0,0|2,0,0]=4 6113 B12R1.367 CCN(C)c1ccc(c(c1)Cl)C 2230a_100000220120_100000210202 [0,2,0,0,0,0|2,0,0]=4 6114 B12R1.367 CCN(C)c1ccc(c(c1)Cl)C 269982a_100000220120_100000204670 [0,2,0,0,0,0|2,0,0]=4 6115 B12R1.367 CCN(C)c1ccc(c(c1)Cl)C 34a_100000220120_100000210202 [0,2,0,0,0,0|2,0,0]=4 6116 B12R1.367 CCN(C)c1ccc(c(c1)Cl)C 38a_100000220120_100000204670 [0,2,0,0,0,0|2,0,0]=4 6117 B12R1.367 CCN(C)c1ccc(c(c1)F)C 2230a_100015205639_200000210301 [0,2,0,0,0,0|2,0,0]=4 6118 B12R1.367 CCN(C)c1ccc(c(c1)F)C 2230a_100160572069_100000210202 [0,2,0,0,0,0|2,0,0]=4 6119 B12R1.367 CCN(C)c1ccc(c(c1)F)C 269982a_100015205639_200000210301 [0,2,0,0,0,0|2,0,0]=4 6120 B12R1.367 CCN(C)c1ccc(c(c1)F)C 269982a_100160572069_100000204670 [0,2,0,0,0,0|2,0,0]=4 6121 B12R1.367 CCN(C)c1ccc(c(c1)F)C 34a_100015205639_200000210301 [0,2,0,0,0,0|2,0,0]=4 6122 B12R1.367 CCN(C)c1ccc(c(c1)F)C 34a_100160572069_100000210202 [0,2,0,0,0,0|2,0,0]=4 6123 B12R1.367 CCN(C)c1ccc(c(c1)F)C 38a_100160572069_100000204670 [0,2,0,0,0,0|2,0,0]=4 6124 B12R1.367 CCN(C)c1ccc(c(c1)F)C 7a_100015205639_200000210301 [0,2,0,0,0,0|2,0,0]=4 6125 B12R1.367 CCN(C)c1ccc(c(c1)F)C 7a_100160572069_100000210202 [0,2,0,0,0,0|2,0,0]=4 6126 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)C 2230a_106256033975_200025704644 [0,2,0,0,0,0|2,0,0]=4 6127 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)C 269982a_106256033975_200025704644 [0,2,0,0,0,0|2,0,0]=4 6128 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)C 34a_106256033975_200025704644 [0,2,0,0,0,0|2,0,0]=4 6129 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)C 7a_106256033975_200025704644 [0,2,0,0,0,0|2,0,0]=4 6130 B12R1.367 CCN([13CH3])c1ccc(c(c1)F)C 2230a_100015205639_200025704644 [0,2,0,0,0,0|2,0,0]=4 6131 B12R1.367 CCN([13CH3])c1ccc(c(c1)F)C 269982a_100015205639_200025704644 [0,2,0,0,0,0|2,0,0]=4 6132 B12R1.367 CCN([13CH3])c1ccc(c(c1)F)C 34a_100015205639_200025704644 [0,2,0,0,0,0|2,0,0]=4 6133 B12R1.367 CCN([13CH3])c1ccc(c(c1)F)C 7a_100015205639_200025704644 [0,2,0,0,0,0|2,0,0]=4 6134 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Br 11a_106832991635_100012339404 [0,2,0,0,0,0|1,0,0]=3 6135 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Br 1626a_100102657272_100012339404 [0,2,0,0,0,0|1,0,0]=3 6136 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Br 240690a_100102657272_100012339404 [0,2,0,0,0,0|1,0,0]=3 6137 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Br 527a_100102657272_100012339404 [0,2,0,0,0,0|1,0,0]=3 6138 B12R1.367 CNC(=O)c1ccc(c(c1)Br)C 11a_106832991635_100000186397 [0,2,0,0,0,0|0,0,0]=2 6139 B12R1.367 CNC(=O)c1ccc(c(c1)Br)C 1626a_100102657272_100000186397 [0,2,0,0,0,0|0,0,0]=2 6140 B12R1.367 CNC(=O)c1ccc(c(c1)Br)C 240690a_100102657272_100000186397 [0,2,0,0,0,0|0,0,0]=2 6141 B12R1.367 CNC(=O)c1ccc(c(c1)Br)C 527a_100102657272_100000186397 [0,2,0,0,0,0|0,0,0]=2 6142 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Cl 11a_106832991635_100000691181 [0,2,0,0,0,0|1,0,0]=3 6143 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Cl 1626a_100102657272_100000691181 [0,2,0,0,0,0|1,0,0]=3 6144 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Cl 240690a_100102657272_100000691181 [0,2,0,0,0,0|1,0,0]=3 6145 B12R1.367 CNC(=O)c1ccc(c(c1)Br)Cl 527a_100102657272_100000691181 [0,2,0,0,0,0|1,0,0]=3 6146 B12R1.367 CNC(=O)c1ccc(c(c1)Br)F 11a_106832991635_100000760357 [0,2,0,0,0,0|1,0,0]=3 6147 B12R1.367 CNC(=O)c1ccc(c(c1)Br)F 1626a_100102657272_100000760357 [0,2,0,0,0,0|1,0,0]=3 6148 B12R1.367 CNC(=O)c1ccc(c(c1)Br)F 240690a_100102657272_100000760357 [0,2,0,0,0,0|1,0,0]=3 6149 B12R1.367 CNC(=O)c1ccc(c(c1)Br)F 527a_100102657272_100000760357 [0,2,0,0,0,0|1,0,0]=3 6150 B12R1.367 CNC(=O)c1ccc(c(c1)Br)I 11a_106832991635_100000739115 [0,2,0,0,0,0|1,0,0]=3 6151 B12R1.367 CNC(=O)c1ccc(c(c1)Br)I 1626a_100102657272_100000739115 [0,2,0,0,0,0|1,0,0]=3 6152 B12R1.367 CNC(=O)c1ccc(c(c1)Br)I 240690a_100102657272_100000739115 [0,2,0,0,0,0|1,0,0]=3 6153 B12R1.367 CNC(=O)c1ccc(c(c1)Br)I 527a_100102657272_100000739115 [0,2,0,0,0,0|1,0,0]=3 6154 B12R1.367 CNC(=O)c1ccc(c(c1)Br)O 240690a_100102657272_100000189672 [0,2,0,0,0,0|1,0,0]=3 6155 B12R1.367 CNC(=O)c1ccc(c(c1)C)Br 11a_106832991635_100000692631 [0,2,0,0,0,0|1,0,0]=3 6156 B12R1.367 CNC(=O)c1ccc(c(c1)C)Br 1626a_100102657272_100000692631 [0,2,0,0,0,0|1,0,0]=3 6157 B12R1.367 CNC(=O)c1ccc(c(c1)C)Br 240690a_100102657272_100000692631 [0,2,0,0,0,0|1,0,0]=3 6158 B12R1.367 CNC(=O)c1ccc(c(c1)C)Br 527a_100102657272_100000692631 [0,2,0,0,0,0|1,0,0]=3 6159 B12R1.367 CNC(=O)c1ccc(c(c1)C)C 11a_106832991635_100000210898 [0,2,0,0,0,0|0,0,0]=2 6160 B12R1.367 CNC(=O)c1ccc(c(c1)C)C 1626a_100102657272_100000210898 [0,2,0,0,0,0|0,0,0]=2 6161 B12R1.367 CNC(=O)c1ccc(c(c1)C)C 240690a_100102657272_100000210898 [0,2,0,0,0,0|0,0,0]=2 6162 B12R1.367 CNC(=O)c1ccc(c(c1)C)C 527a_100102657272_100000210898 [0,2,0,0,0,0|0,0,0]=2 6163 B12R1.367 CNC(=O)c1ccc(c(c1)C)Cl 11a_106832991635_100000686306 [0,2,0,0,0,0|1,0,0]=3 6164 B12R1.367 CNC(=O)c1ccc(c(c1)C)Cl 1626a_100102657272_100000686306 [0,2,0,0,0,0|1,0,0]=3 6165 B12R1.367 CNC(=O)c1ccc(c(c1)C)Cl 240690a_100102657272_100000686306 [0,2,0,0,0,0|1,0,0]=3 6166 B12R1.367 CNC(=O)c1ccc(c(c1)C)Cl 527a_100102657272_100000686306 [0,2,0,0,0,0|1,0,0]=3 6167 B12R1.367 CNC(=O)c1ccc(c(c1)C)F 11a_106832991635_100000751819 [0,2,0,0,0,0|1,0,0]=3 6168 B12R1.367 CNC(=O)c1ccc(c(c1)C)F 1626a_100102657272_100000751819 [0,2,0,0,0,0|1,0,0]=3 6169 B12R1.367 CNC(=O)c1ccc(c(c1)C)F 240690a_100102657272_100000751819 [0,2,0,0,0,0|1,0,0]=3 6170 B12R1.367 CNC(=O)c1ccc(c(c1)C)F 527a_100102657272_100000751819 [0,2,0,0,0,0|1,0,0]=3 6171 B12R1.367 CNC(=O)c1ccc(c(c1)C)I 11a_106832991635_100000751300 [0,2,0,0,0,0|1,0,0]=3 6172 B12R1.367 CNC(=O)c1ccc(c(c1)C)I 1626a_100102657272_100000751300 [0,2,0,0,0,0|1,0,0]=3 6173 B12R1.367 CNC(=O)c1ccc(c(c1)C)I 240690a_100102657272_100000751300 [0,2,0,0,0,0|1,0,0]=3 6174 B12R1.367 CNC(=O)c1ccc(c(c1)C)I 527a_100102657272_100000751300 [0,2,0,0,0,0|1,0,0]=3 6175 B12R1.367 CNC(=O)c1ccc(c(c1)C)O 240690a_100102657272_100000685612 [0,2,0,0,0,0|1,0,0]=3 6176 B12R1.367 CNC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200013065384 [0,2,0,0,0,0|1,0,0]=3 6177 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Br 11a_106832991635_100000687082 [0,2,0,0,0,0|1,0,0]=3 6178 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Br 1626a_100102657272_100000687082 [0,2,0,0,0,0|1,0,0]=3 6179 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Br 240690a_100102657272_100000687082 [0,2,0,0,0,0|1,0,0]=3 6180 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Br 527a_100102657272_100000687082 [0,2,0,0,0,0|1,0,0]=3 6181 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)C 11a_106832991635_100000751740 [0,2,0,0,0,0|0,0,0]=2 6182 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)C 1626a_100102657272_100000751740 [0,2,0,0,0,0|0,0,0]=2 6183 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)C 240690a_100102657272_100000751740 [0,2,0,0,0,0|0,0,0]=2 6184 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)C 527a_100102657272_100000751740 [0,2,0,0,0,0|0,0,0]=2 6185 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Cl 11a_106832991635_100000210401 [0,2,0,0,0,0|1,0,0]=3 6186 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Cl 1626a_100102657272_100000210401 [0,2,0,0,0,0|1,0,0]=3 6187 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Cl 240690a_100102657272_100000210401 [0,2,0,0,0,0|1,0,0]=3 6188 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)Cl 527a_100102657272_100000210401 [0,2,0,0,0,0|1,0,0]=3 6189 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)F 11a_106832991635_100000686462 [0,2,0,0,0,0|1,0,0]=3 6190 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)F 1626a_100102657272_100000686462 [0,2,0,0,0,0|1,0,0]=3 6191 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)F 240690a_100102657272_100000686462 [0,2,0,0,0,0|1,0,0]=3 6192 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)F 527a_100102657272_100000686462 [0,2,0,0,0,0|1,0,0]=3 6193 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)I 11a_106832991635_100000684831 [0,2,0,0,0,0|1,0,0]=3 6194 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)I 1626a_100102657272_100000684831 [0,2,0,0,0,0|1,0,0]=3 6195 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)I 240690a_100102657272_100000684831 [0,2,0,0,0,0|1,0,0]=3 6196 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)I 527a_100102657272_100000684831 [0,2,0,0,0,0|1,0,0]=3 6197 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)O 240690a_100102657272_100000212196 [0,2,0,0,0,0|1,0,0]=3 6198 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)O 527a_100102657272_100000212196 [0,2,0,0,0,0|1,0,0]=3 6199 B12R1.367 CNC(=O)c1ccc(c(c1)F)Br 11a_106832991635_100000743946 [0,2,0,0,0,0|1,0,0]=3 6200 B12R1.367 CNC(=O)c1ccc(c(c1)F)Br 1626a_100102657272_100000743946 [0,2,0,0,0,0|1,0,0]=3 6201 B12R1.367 CNC(=O)c1ccc(c(c1)F)Br 240690a_100102657272_100000743946 [0,2,0,0,0,0|1,0,0]=3 6202 B12R1.367 CNC(=O)c1ccc(c(c1)F)Br 527a_100102657272_100000743946 [0,2,0,0,0,0|1,0,0]=3 6203 B12R1.367 CNC(=O)c1ccc(c(c1)F)C 11a_106832991635_100000212313 [0,2,0,0,0,0|0,0,0]=2 6204 B12R1.367 CNC(=O)c1ccc(c(c1)F)C 1626a_100102657272_100000212313 [0,2,0,0,0,0|0,0,0]=2 6205 B12R1.367 CNC(=O)c1ccc(c(c1)F)C 240690a_100102657272_100000212313 [0,2,0,0,0,0|0,0,0]=2 6206 B12R1.367 CNC(=O)c1ccc(c(c1)F)C 527a_100102657272_100000212313 [0,2,0,0,0,0|0,0,0]=2 6207 B12R1.367 CNC(=O)c1ccc(c(c1)F)Cl 11a_106832991635_100000743183 [0,2,0,0,0,0|1,0,0]=3 6208 B12R1.367 CNC(=O)c1ccc(c(c1)F)Cl 1626a_100102657272_100000743183 [0,2,0,0,0,0|1,0,0]=3 6209 B12R1.367 CNC(=O)c1ccc(c(c1)F)Cl 240690a_100102657272_100000743183 [0,2,0,0,0,0|1,0,0]=3 6210 B12R1.367 CNC(=O)c1ccc(c(c1)F)Cl 527a_100102657272_100000743183 [0,2,0,0,0,0|1,0,0]=3 6211 B12R1.367 CNC(=O)c1ccc(c(c1)F)F 11a_106832991635_100000209822 [0,2,0,0,0,0|1,0,0]=3 6212 B12R1.367 CNC(=O)c1ccc(c(c1)F)F 1626a_100102657272_100000209822 [0,2,0,0,0,0|1,0,0]=3 6213 B12R1.367 CNC(=O)c1ccc(c(c1)F)F 240690a_100102657272_100000209822 [0,2,0,0,0,0|1,0,0]=3 6214 B12R1.367 CNC(=O)c1ccc(c(c1)F)F 527a_100102657272_100000209822 [0,2,0,0,0,0|1,0,0]=3 6215 B12R1.367 CNC(=O)c1ccc(c(c1)F)I 11a_106832991635_100000062624 [0,2,0,0,0,0|1,0,0]=3 6216 B12R1.367 CNC(=O)c1ccc(c(c1)F)I 1626a_100102657272_100000062624 [0,2,0,0,0,0|1,0,0]=3 6217 B12R1.367 CNC(=O)c1ccc(c(c1)F)I 240690a_100102657272_100000062624 [0,2,0,0,0,0|1,0,0]=3 6218 B12R1.367 CNC(=O)c1ccc(c(c1)F)I 527a_100102657272_100000062624 [0,2,0,0,0,0|1,0,0]=3 6219 B12R1.367 CNC(=O)c1ccc(c(c1)F)O 240690a_100102657272_100000185466 [0,2,0,0,0,0|1,0,0]=3 6220 B12R1.367 CNC(=O)c1ccc(c(c1)F)O 527a_100102657272_100000185466 [0,2,0,0,0,0|1,0,0]=3 6221 B12R1.367 CNC(=O)c1ccc(c(c1)I)Br 11a_106832991635_100012343876 [0,2,0,0,0,0|1,0,0]=3 6222 B12R1.367 CNC(=O)c1ccc(c(c1)I)Br 1626a_100102657272_100012343876 [0,2,0,0,0,0|1,0,0]=3 6223 B12R1.367 CNC(=O)c1ccc(c(c1)I)Br 240690a_100102657272_100012343876 [0,2,0,0,0,0|1,0,0]=3 6224 B12R1.367 CNC(=O)c1ccc(c(c1)I)Br 527a_100102657272_100012343876 [0,2,0,0,0,0|1,0,0]=3 6225 B12R1.367 CNC(=O)c1ccc(c(c1)I)C 11a_106832991635_100000751299 [0,2,0,0,0,0|0,0,0]=2 6226 B12R1.367 CNC(=O)c1ccc(c(c1)I)C 1626a_100102657272_100000751299 [0,2,0,0,0,0|0,0,0]=2 6227 B12R1.367 CNC(=O)c1ccc(c(c1)I)C 240690a_100102657272_100000751299 [0,2,0,0,0,0|0,0,0]=2 6228 B12R1.367 CNC(=O)c1ccc(c(c1)I)C 527a_100102657272_100000751299 [0,2,0,0,0,0|0,0,0]=2 6229 B12R1.367 CNC(=O)c1ccc(c(c1)I)Cl 11a_106832991635_100000739381 [0,2,0,0,0,0|1,0,0]=3 6230 B12R1.367 CNC(=O)c1ccc(c(c1)I)Cl 1626a_100102657272_100000739381 [0,2,0,0,0,0|1,0,0]=3 6231 B12R1.367 CNC(=O)c1ccc(c(c1)I)Cl 240690a_100102657272_100000739381 [0,2,0,0,0,0|1,0,0]=3 6232 B12R1.367 CNC(=O)c1ccc(c(c1)I)Cl 527a_100102657272_100000739381 [0,2,0,0,0,0|1,0,0]=3 6233 B12R1.367 CNC(=O)c1ccc(c(c1)I)F 11a_106832991635_100000688015 [0,2,0,0,0,0|1,0,0]=3 6234 B12R1.367 CNC(=O)c1ccc(c(c1)I)F 1626a_100102657272_100000688015 [0,2,0,0,0,0|1,0,0]=3 6235 B12R1.367 CNC(=O)c1ccc(c(c1)I)F 240690a_100102657272_100000688015 [0,2,0,0,0,0|1,0,0]=3 6236 B12R1.367 CNC(=O)c1ccc(c(c1)I)F 527a_100102657272_100000688015 [0,2,0,0,0,0|1,0,0]=3 6237 B12R1.367 CNC(=O)c1ccc(c(c1)I)I 11a_106832991635_100000725830 [0,2,0,0,0,0|1,0,0]=3 6238 B12R1.367 CNC(=O)c1ccc(c(c1)I)I 1626a_100102657272_100000725830 [0,2,0,0,0,0|1,0,0]=3 6239 B12R1.367 CNC(=O)c1ccc(c(c1)I)I 240690a_100102657272_100000725830 [0,2,0,0,0,0|1,0,0]=3 6240 B12R1.367 CNC(=O)c1ccc(c(c1)I)I 527a_100102657272_100000725830 [0,2,0,0,0,0|1,0,0]=3 6241 B12R1.367 CNC(=O)c1ccc(c(c1)I)O 1626a_100102657272_100000037485 [0,2,0,0,0,0|1,0,0]=3 6242 B12R1.367 CNC(=O)c1ccc(c(c1)I)O 240690a_100102657272_100000037485 [0,2,0,0,0,0|1,0,0]=3 6243 B12R1.367 CNC(=O)c1ccc(c(c1)O)Br 240690a_100102657272_100000689001 [0,2,0,0,0,0|1,0,0]=3 6244 B12R1.367 CNC(=O)c1ccc(c(c1)O)Br 527a_100102657272_100000689001 [0,2,0,0,0,0|1,0,0]=3 6245 B12R1.367 CNC(=O)c1ccc(c(c1)O)C 240690a_100102657272_100000233767 [0,2,0,0,0,0|0,0,0]=2 6246 B12R1.367 CNC(=O)c1ccc(c(c1)O)Cl 240690a_100102657272_100011933997 [0,2,0,0,0,0|1,0,0]=3 6247 B12R1.367 CNC(=O)c1ccc(c(c1)O)Cl 527a_100102657272_100011933997 [0,2,0,0,0,0|1,0,0]=3 6248 B12R1.367 CNC(=O)c1ccc(c(c1)O)F 240690a_100102657272_100000035894 [0,2,0,0,0,0|1,0,0]=3 6249 B12R1.367 CNC(=O)c1ccc(c(c1)O)F 271570a_203496583355_200012359898 [0,2,0,0,0,0|1,0,0]=3 6250 B12R1.367 CNC(=O)c1ccc(c(c1)O)F 527a_100102657272_100000035894 [0,2,0,0,0,0|1,0,0]=3 6251 B12R1.367 CNC(=O)c1ccc(c(c1)O)I 1626a_100102657272_100000239334 [0,2,0,0,0,0|1,0,0]=3 6252 B12R1.367 CNC(=O)c1ccc(c(c1)O)I 240690a_100102657272_100000239334 [0,2,0,0,0,0|1,0,0]=3 6253 B12R1.367 CNC(=O)c1ccc(c(c1)O)I 527a_100102657272_100000239334 [0,2,0,0,0,0|1,0,0]=3 6254 B12R1.367 CNC(C)c1ccc(c(c1)Br)C 269862a_106832991636_100011934287 [0,2,0,0,0,0|1,0,1]=4 6255 B12R1.367 CNC(C)c1ccc(c(c1)C)C 269862a_106832991636_100000210971 [0,2,0,0,0,0|1,0,1]=4 6256 B12R1.367 CNC(C)c1ccc(c(c1)Cl)C 2230a_100012005020_200000210301 [0,2,0,0,0,0|1,0,1]=4 6257 B12R1.367 CNC(C)c1ccc(c(c1)Cl)C 269862a_106832991636_100012002458 [0,2,0,0,0,0|1,0,1]=4 6258 B12R1.367 CNC(C)c1ccc(c(c1)Cl)C 34a_100012005020_200000210301 [0,2,0,0,0,0|1,0,1]=4 6259 B12R1.367 CNC(C)c1ccc(c(c1)F)C 269862a_106832991636_100000767010 [0,2,0,0,0,0|1,0,1]=4 6260 B12R1.367 CNC(C)c1ccc(c(c1)O)C 269862a_106832991636_100000084092 [0,2,0,0,0,0|1,0,1]=4 6261 B12R1.367 CN[C@@H](C)c1ccc(c(c1)F)C 2230a_100011997884_200000210301 [0,2,0,0,0,0|1,0,1]=4 6262 B12R1.367 CN[C@@H](C)c1ccc(c(c1)F)C 34a_100011997884_200000210301 [0,2,0,0,0,0|1,0,1]=4 6263 B12R1.367 CN[C@H](C)c1ccc(c(c1)C)C 2230a_100015184928_200000210301 [0,2,0,0,0,0|1,0,1]=4 6264 B12R1.367 CN[C@H](C)c1ccc(c(c1)C)C 34a_100015184928_200000210301 [0,2,0,0,0,0|1,0,1]=4 6265 B12R1.367 COC(=O)c1cc(c(cn1)C)O 271570a_203496583355_100000065005 [0,2,0,0,0,0|1,0,0]=3 6266 B12R1.367 COC(=O)c1cc(c(cn1)O)C 271570a_203496583355_100010080863 [0,2,0,0,0,0|2,0,0]=4 6267 B12R1.367 COC(=O)c1cc(c(cn1)O)N 271570a_203496583355_100016001589 [0,2,0,0,0,0|2,0,0]=4 6268 B12R1.367 COC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100011294788 [0,2,0,0,0,0|1,0,0]=3 6269 B12R1.367 COC(=O)c1ccc(c(c1)C)O 271570a_203496583355_100011215878 [0,2,0,0,0,0|1,0,0]=3 6270 B12R1.367 COC(=O)c1ccc(c(c1)Cl)O 271570a_203496583355_100012356344 [0,2,0,0,0,0|1,0,0]=3 6271 B12R1.367 COC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100000703229 [0,2,0,0,0,0|1,0,0]=3 6272 B12R1.367 COC(=O)c1ccc(c(c1)N)O 271570a_203496583355_100011450966 [0,2,0,0,0,0|1,0,0]=3 6273 B12R1.367 COC(=O)c1ccc(c(c1)O)Br 271570a_203496583355_100012349818 [0,2,0,0,0,0|1,0,0]=3 6274 B12R1.367 COC(=O)c1ccc(c(c1)O)C 271570a_203496583355_100011218856 [0,2,0,0,0,0|0,0,0]=2 6275 B12R1.367 COC(=O)c1ccc(c(c1)O)Cl 271570a_203496583355_100011294800 [0,2,0,0,0,0|1,0,0]=3 6276 B12R1.367 COC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100000722584 [0,2,0,0,0,0|1,0,0]=3 6277 B12R1.367 COC(=O)c1ccc(c(c1)O)N 271570a_203496583355_100000187552 [0,2,0,0,0,0|1,0,0]=3 6278 B12R1.367 COC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100000216328 [0,2,0,0,0,0|1,0,0]=3 6279 B12R1.367 COC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012350776 [0,2,0,0,0,0|1,0,0]=3 6280 B12R1.367 COC(=O)c1ccc(c(n1)C)O 271570a_203496583355_100010207261 [0,2,0,0,0,0|2,0,0]=4 6281 B12R1.367 COC(=O)c1ccc(c(n1)F)O 271570a_203496583355_100010189630 [0,2,0,0,0,0|2,0,0]=4 6282 B12R1.367 COC(=O)c1ccc(c(n1)N)O 271570a_203496583355_100010187631 [0,2,0,0,0,0|2,0,0]=4 6283 B12R1.367 COC(=O)c1ccc(c(n1)O)C 271570a_203496583355_100010143800 [0,2,0,0,0,0|1,0,0]=3 6284 B12R1.367 COC(=O)c1ccc(c(n1)O)F 271570a_203496583355_100010189626 [0,2,0,0,0,0|2,0,0]=4 6285 B12R1.367 COC(=O)c1ccc(c(n1)O)O 271570a_203496583355_100010189637 [0,2,0,0,0,0|2,0,0]=4 6286 B12R1.367 COC(=O)c1ccc(c(n1)O)O 271570a_203496583355_200009815348 [0,2,0,0,0,0|2,0,0]=4 6287 B12R1.367 COC(=O)c1cnc(c(c1)Br)O 271570a_203496583355_100010114297 [0,2,0,0,0,0|2,0,0]=4 6288 B12R1.367 COC(=O)c1cnc(c(c1)C)O 271570a_203496583355_100009862495 [0,2,0,0,0,0|2,0,0]=4 6289 B12R1.367 COC(=O)c1cnc(c(c1)F)O 271570a_203496583355_100010189625 [0,2,0,0,0,0|2,0,0]=4 6290 B12R1.367 COC(=O)c1cnc(c(c1)N)O 271570a_203496583355_100000079130 [0,2,0,0,0,0|2,0,0]=4 6291 B12R1.367 COC(=O)c1cnc(c(c1)O)Cl 271570a_203496583355_100010188758 [0,2,0,0,0,0|2,0,0]=4 6292 B12R1.367 COC(=O)c1cnc(c(c1)O)F 271570a_203496583355_100000117919 [0,2,0,0,0,0|2,0,0]=4 6293 B12R1.367 COC(=O)c1cnc(c(c1)O)N 271570a_203496583355_100009816800 [0,2,0,0,0,0|2,0,0]=4 6294 B12R1.367 COC(=O)c1cnc(c(c1)O)O 271570a_203496583355_100010109663 [0,2,0,0,0,0|2,0,0]=4 6295 B12R1.367 COC(=O)c1cnc(c(c1)O)O 271570a_203496583355_100010999399 [0,2,0,0,0,0|2,0,0]=4 6296 B12R1.367 COC(=O)c1cnc(c(n1)O)C 271570a_203496583355_200010778766 [0,2,0,0,0,0|2,0,0]=4 6297 B12R1.367 COC(=O)c1coc(=O)c(c1)O 271570a_203496583355_100009812866 [0,2,0,0,0,0|2,0,0]=4 6298 B12R1.367 Cc1cc(ccc1Br)C(=O)CF 1458a_100000692631_100015361967 [0,2,0,0,0,0|1,0,0]=3 6299 B12R1.367 Cc1cc(ccc1Cl)C(=O)CF 1458a_100000686306_100015361967 [0,2,0,0,0,0|1,0,0]=3 6300 B12R1.367 Cc1cc(ccc1F)C(=O)CF 1458a_100000751819_100015361967 [0,2,0,0,0,0|1,0,0]=3 6301 B12R1.367 Cc1cc(ccc1I)C(=O)CF 1458a_100000751300_100015361967 [0,2,0,0,0,0|1,0,0]=3 6302 B12R1.367 Cc1cc(ccc1O)C(=O)CF 1458a_100000685612_100015361967 [0,2,0,0,0,0|1,0,0]=3 6303 B12R1.367 Cc1cc(ccc1O)C(=O)NN 271570a_203496583355_100012339724 [0,2,0,0,0,0|2,0,0]=4 6304 B12R1.367 Cc1ccc(cc1Br)C(=O)CF 1458a_100000186397_100015361967 [0,2,0,0,0,0|0,0,0]=2 6305 B12R1.367 Cc1ccc(cc1Br)N(C)CF 269982a_100000707694_100015361967 [0,2,0,0,0,0|2,0,0]=4 6306 B12R1.367 Cc1ccc(cc1Br)N(C)CF 34a_100000707694_100015361967 [0,2,0,0,0,0|2,0,0]=4 6307 B12R1.367 Cc1ccc(cc1Br)N(C)CF 38a_100000707694_100015361967 [0,2,0,0,0,0|2,0,0]=4 6308 B12R1.367 Cc1ccc(cc1C)C(=O)CF 1458a_100000210898_100015361967 [0,2,0,0,0,0|0,0,0]=2 6309 B12R1.367 Cc1ccc(cc1C)[C@@H](C)N[13CH3] 2230a_100015184928_200025704644 [0,2,0,0,0,0|1,0,1]=4 6310 B12R1.367 Cc1ccc(cc1C)[C@@H](C)N[13CH3] 34a_100015184928_200025704644 [0,2,0,0,0,0|1,0,1]=4 6311 B12R1.367 Cc1ccc(cc1Cl)C(=O)CF 1458a_100000751740_100015361967 [0,2,0,0,0,0|0,0,0]=2 6312 B12R1.367 Cc1ccc(cc1Cl)C(C)N[13CH3] 2230a_100012005020_200025704644 [0,2,0,0,0,0|1,0,1]=4 6313 B12R1.367 Cc1ccc(cc1Cl)C(C)N[13CH3] 34a_100012005020_200025704644 [0,2,0,0,0,0|1,0,1]=4 6314 B12R1.367 Cc1ccc(cc1Cl)N(C)CF 269982a_100000220120_100015361967 [0,2,0,0,0,0|2,0,0]=4 6315 B12R1.367 Cc1ccc(cc1Cl)N(C)CF 34a_100000220120_100015361967 [0,2,0,0,0,0|2,0,0]=4 6316 B12R1.367 Cc1ccc(cc1Cl)N(C)CF 38a_100000220120_100015361967 [0,2,0,0,0,0|2,0,0]=4 6317 B12R1.367 Cc1ccc(cc1F)C(=O)CF 1458a_100000212313_100015361967 [0,2,0,0,0,0|0,0,0]=2 6318 B12R1.367 Cc1ccc(cc1F)N(C)CF 269982a_100160572069_100015361967 [0,2,0,0,0,0|2,0,0]=4 6319 B12R1.367 Cc1ccc(cc1F)N(C)CF 34a_100160572069_100015361967 [0,2,0,0,0,0|2,0,0]=4 6320 B12R1.367 Cc1ccc(cc1F)N(C)CF 38a_100160572069_100015361967 [0,2,0,0,0,0|2,0,0]=4 6321 B12R1.367 Cc1ccc(cc1F)N(C)CF 7a_100160572069_100015361967 [0,2,0,0,0,0|2,0,0]=4 6322 B12R1.367 Cc1ccc(cc1F)[C@H](C)N[13CH3] 2230a_100011997884_200025704644 [0,2,0,0,0,0|1,0,1]=4 6323 B12R1.367 Cc1ccc(cc1F)[C@H](C)N[13CH3] 34a_100011997884_200025704644 [0,2,0,0,0,0|1,0,1]=4 6324 B12R1.367 Cc1ccc(cc1I)C(=O)CF 1458a_100000751299_100015361967 [0,2,0,0,0,0|0,0,0]=2 6325 B12R1.367 Cc1ccc(cc1O)C(=O)CF 1458a_100000233767_100015361967 [0,2,0,0,0,0|0,0,0]=2 6326 B12R1.367 Cc1ccc(cc1O)C(=O)NN 271570a_203496583355_100000188075 [0,2,0,0,0,0|1,0,0]=3 6327 B12R1.367 NCC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100016989600 [0,2,0,0,0,0|1,0,0]=3 6328 B12R1.367 NNC(=O)c1ccc(c(c1)O)Cl 271570a_203496583355_100000046573 [0,2,0,0,0,0|2,0,0]=4 6329 B12R1.367 O=C(CF)c1ccc(c(c1)Br)Br 1458a_100012339404_100015361967 [0,2,0,0,0,0|1,0,0]=3 6330 B12R1.367 O=C(CF)c1ccc(c(c1)Br)Cl 1458a_100000691181_100015361967 [0,2,0,0,0,0|1,0,0]=3 6331 B12R1.367 O=C(CF)c1ccc(c(c1)Br)F 1458a_100000760357_100015361967 [0,2,0,0,0,0|1,0,0]=3 6332 B12R1.367 O=C(CF)c1ccc(c(c1)Br)I 1458a_100000739115_100015361967 [0,2,0,0,0,0|1,0,0]=3 6333 B12R1.367 O=C(CF)c1ccc(c(c1)Br)O 1458a_100000189672_100015361967 [0,2,0,0,0,0|1,0,0]=3 6334 B12R1.367 O=C(CF)c1ccc(c(c1)Cl)Br 1458a_100000687082_100015361967 [0,2,0,0,0,0|1,0,0]=3 6335 B12R1.367 O=C(CF)c1ccc(c(c1)Cl)Cl 1458a_100000210401_100015361967 [0,2,0,0,0,0|1,0,0]=3 6336 B12R1.367 O=C(CF)c1ccc(c(c1)Cl)F 1458a_100000686462_100015361967 [0,2,0,0,0,0|1,0,0]=3 6337 B12R1.367 O=C(CF)c1ccc(c(c1)Cl)I 1458a_100000684831_100015361967 [0,2,0,0,0,0|1,0,0]=3 6338 B12R1.367 O=C(CF)c1ccc(c(c1)Cl)O 1458a_100000212196_100015361967 [0,2,0,0,0,0|1,0,0]=3 6339 B12R1.367 O=C(CF)c1ccc(c(c1)F)Br 1458a_100000743946_100015361967 [0,2,0,0,0,0|1,0,0]=3 6340 B12R1.367 O=C(CF)c1ccc(c(c1)F)Cl 1458a_100000743183_100015361967 [0,2,0,0,0,0|1,0,0]=3 6341 B12R1.367 O=C(CF)c1ccc(c(c1)F)F 1458a_100000209822_100015361967 [0,2,0,0,0,0|1,0,0]=3 6342 B12R1.367 O=C(CF)c1ccc(c(c1)F)I 1458a_100000062624_100015361967 [0,2,0,0,0,0|1,0,0]=3 6343 B12R1.367 O=C(CF)c1ccc(c(c1)F)O 1458a_100000185466_100015361967 [0,2,0,0,0,0|1,0,0]=3 6344 B12R1.367 O=C(CF)c1ccc(c(c1)I)Br 1458a_100012343876_100015361967 [0,2,0,0,0,0|1,0,0]=3 6345 B12R1.367 O=C(CF)c1ccc(c(c1)I)Cl 1458a_100000739381_100015361967 [0,2,0,0,0,0|1,0,0]=3 6346 B12R1.367 O=C(CF)c1ccc(c(c1)I)F 1458a_100000688015_100015361967 [0,2,0,0,0,0|1,0,0]=3 6347 B12R1.367 O=C(CF)c1ccc(c(c1)I)I 1458a_100000725830_100015361967 [0,2,0,0,0,0|1,0,0]=3 6348 B12R1.367 O=C(CF)c1ccc(c(c1)I)O 1458a_100000037485_100015361967 [0,2,0,0,0,0|1,0,0]=3 6349 B12R1.367 O=C(CF)c1ccc(c(c1)O)Br 1458a_100000689001_100015361967 [0,2,0,0,0,0|1,0,0]=3 6350 B12R1.367 O=C(CF)c1ccc(c(c1)O)Cl 1458a_100011933997_100015361967 [0,2,0,0,0,0|1,0,0]=3 6351 B12R1.367 O=C(CF)c1ccc(c(c1)O)F 1458a_100000035894_100015361967 [0,2,0,0,0,0|1,0,0]=3 6352 B12R1.367 O=C(CF)c1ccc(c(c1)O)I 1458a_100000239334_100015361967 [0,2,0,0,0,0|1,0,0]=3 6353 B12R1.367 O=C(CF)c1ccc(c(c1)O)O 1458a_100000212155_100015361967 [0,2,0,0,0,0|1,0,0]=3 6354 B12R1.893 C=C(C)c1ccc(c(c1C)C)Br 271570a_100000694244_200010185626 [0,2,0,0,0,0|2,0,0]=4 6355 B12R1.893 C=C(C)c1ccc(c(c1C)C)F 271570a_100000694244_100009816033 [0,2,0,0,0,0|2,0,0]=4 6356 B12R1.893 C=C(C)c1ccc(c(c1C)C)N 271570a_100000694244_100009816967 [0,2,0,0,0,0|2,0,0]=4 6357 B12R1.893 C=C(C)c1ccc(c(c1C)C)O 271570a_100000694244_100012353674 [0,2,0,0,0,0|2,0,0]=4 6358 B12R1.893 C=C(C)c1ccc(c(c1C)Cl)Br 271570a_100000694244_200010212245 [0,2,0,0,0,0|2,0,0]=4 6359 B12R1.893 C=C(C)c1ccc(c(c1C)F)Br 271570a_100000694244_100010208201 [0,2,0,0,0,0|2,0,0]=4 6360 B12R1.893 C=C(C)c1ccc(c(c1C)F)F 271570a_100000694244_100009815991 [0,2,0,0,0,0|2,0,0]=4 6361 B12R1.893 C=C(C)c1ccc(c(c1C)F)N 271570a_100000694244_100000722916 [0,2,0,0,0,0|2,0,0]=4 6362 B12R1.893 C=C(C)c1ccc(c(c1C)N)C 271570a_100000694244_200010074581 [0,2,0,0,0,0|1,0,0]=3 6363 B12R1.893 C=C(C)c1ccc(c(c1C)N)F 271570a_100000694244_100010588651 [0,2,0,0,0,0|2,0,0]=4 6364 B12R1.893 C=C(C)c1ccc(c(c1C)N)N 271570a_100000694244_100010009725 [0,2,0,0,0,0|2,0,0]=4 6365 B12R1.893 C=C(C)c1ccc(c(c1C)N)O 271570a_100000694244_100013039247 [0,2,0,0,0,0|2,0,0]=4 6366 B12R1.893 C=C(C)c1ccc(c(c1Cl)C)Br 271570a_100000694244_100055076181 [0,2,0,0,0,0|2,0,0]=4 6367 B12R1.893 C=C(C)c1ccc(c(c1Cl)C)Cl 271570a_100000694244_100010730154 [0,2,0,0,0,0|2,0,0]=4 6368 B12R1.893 C=C(C)c1ccc(c(c1Cl)Cl)Br 271570a_100000694244_200012356690 [0,2,0,0,0,0|2,0,0]=4 6369 B12R1.893 C=C(C)c1ccc(c(c1F)Br)F 271570a_100000694244_100010167943 [0,2,0,0,0,0|2,0,0]=4 6370 B12R1.893 C=C(C)c1ccc(c(c1F)Br)N 271570a_100000694244_100015781493 [0,2,0,0,0,0|2,0,0]=4 6371 B12R1.893 C=C(C)c1ccc(c(c1F)C)C 271570a_100000694244_200015555822 [0,2,0,0,0,0|1,0,0]=3 6372 B12R1.893 C=C(C)c1ccc(c(c1F)C)F 271570a_100000694244_100009815987 [0,2,0,0,0,0|2,0,0]=4 6373 B12R1.893 C=C(C)c1ccc(c(c1F)C)N 271570a_100000694244_100010208198 [0,2,0,0,0,0|2,0,0]=4 6374 B12R1.893 C=C(C)c1ccc(c(c1F)C)O 271570a_100000694244_100010390934 [0,2,0,0,0,0|2,0,0]=4 6375 B12R1.893 C=C(C)c1ccc(c(c1F)Cl)Br 271570a_100000694244_100010212236 [0,2,0,0,0,0|2,0,0]=4 6376 B12R1.893 C=C(C)c1ccc(c(c1F)Cl)F 271570a_100000694244_200000038702 [0,2,0,0,0,0|2,0,0]=4 6377 B12R1.893 C=C(C)c1ccc(c(c1F)F)Br 271570a_100000694244_100010212264 [0,2,0,0,0,0|2,0,0]=4 6378 B12R1.893 C=C(C)c1ccc(c(c1F)F)C 271570a_100000694244_100012766498 [0,2,0,0,0,0|1,0,0]=3 6379 B12R1.893 C=C(C)c1ccc(c(c1F)F)F 271570a_100000694244_100000750562 [0,2,0,0,0,0|2,0,0]=4 6380 B12R1.893 C=C(C)c1ccc(c(c1F)F)N 271570a_100000694244_100010200256 [0,2,0,0,0,0|2,0,0]=4 6381 B12R1.893 C=C(C)c1ccc(c(c1F)F)O 271570a_100000694244_100011830415 [0,2,0,0,0,0|2,0,0]=4 6382 B12R1.893 C=C(C)c1ccc(c(c1F)N)F 271570a_100000694244_100025793129 [0,2,0,0,0,0|2,0,0]=4 6383 B12R1.893 C=C(C)c1ccc(c(c1F)N)N 271570a_100000694244_100009814308 [0,2,0,0,0,0|2,0,0]=4 6384 B12R1.893 C=C(C)c1ccc(c(c1F)O)Br 271570a_100000694244_200010782288 [0,2,0,0,0,0|2,0,0]=4 6385 B12R1.893 C=C(C)c1ccc(c(c1F)O)F 271570a_100000694244_100010167067 [0,2,0,0,0,0|2,0,0]=4 6386 B12R1.893 C=C(C)c1ccc(c(c1N)C)F 271570a_100000694244_100011009917 [0,2,0,0,0,0|2,0,0]=4 6387 B12R1.893 C=C(C)c1ccc(c(c1N)F)F 271570a_100000694244_100010008850 [0,2,0,0,0,0|2,0,0]=4 6388 B12R1.893 C=C(C)c1ccc(c(c1N)N)F 271570a_100000694244_100011102919 [0,2,0,0,0,0|2,0,0]=4 6389 B12R1.893 C=C(C)c1ccc(c(c1N)O)Br 271570a_100000694244_100020748643 [0,2,0,0,0,0|2,0,0]=4 6390 B12R1.893 C=C(C)c1ccc(c(c1O)C)F 271570a_100000694244_200010391124 [0,2,0,0,0,0|2,0,0]=4 6391 B12R1.893 C=C(C)c1ccc(c(c1O)F)C 271570a_100000694244_100000722096 [0,2,0,0,0,0|1,0,0]=3 6392 B12R1.893 C=C(C)c1ccc(c(c1O)F)F 271570a_100000694244_100010243909 [0,2,0,0,0,0|2,0,0]=4 6393 B12R1.893 C=C(C)c1ncc(c(c1N)N)C 271570a_100000694244_200000097298 [0,2,0,0,0,0|2,0,0]=4 6394 B12R1.893 CC(=O)c1ccc(c(c1Br)F)F 1458a_100012356454_200000210301 [0,2,0,0,0,0|1,0,0]=3 6395 B12R1.893 CC(=O)c1ccc(c(c1Br)O)Br 1458a_100016068111_200000210301 [0,2,0,0,0,0|1,0,0]=3 6396 B12R1.893 CC(=O)c1ccc(c(c1C)F)F 1458a_100000061971_200000210301 [0,2,0,0,0,0|1,0,0]=3 6397 B12R1.893 CC(=O)c1ccc(c(c1Cl)Br)Cl 1458a_100010208263_200000210301 [0,2,0,0,0,0|1,0,0]=3 6398 B12R1.893 CC(=O)c1ccc(c(c1Cl)C)Cl 1458a_100010074829_200000210301 [0,2,0,0,0,0|1,0,0]=3 6399 B12R1.893 CC(=O)c1ccc(c(c1Cl)C)F 1458a_100000061447_200000210301 [0,2,0,0,0,0|1,0,0]=3 6400 B12R1.893 CC(=O)c1ccc(c(c1Cl)Cl)Br 1458a_200012347731_200000210301 [0,2,0,0,0,0|1,0,0]=3 6401 B12R1.893 CC(=O)c1ccc(c(c1Cl)Cl)F 1458a_100010209669_200000210301 [0,2,0,0,0,0|1,0,0]=3 6402 B12R1.893 CC(=O)c1ccc(c(c1Cl)F)Cl 1458a_200010192171_200000210301 [0,2,0,0,0,0|1,0,0]=3 6403 B12R1.893 CC(=O)c1ccc(c(c1Cl)F)F 1458a_100009888510_200000210301 [0,2,0,0,0,0|1,0,0]=3 6404 B12R1.893 CC(=O)c1ccc(c(c1Cl)O)O 1458a_100009910189_200000210301 [0,2,0,0,0,0|1,0,0]=3 6405 B12R1.893 CC(=O)c1ccc(c(c1F)Br)Br 1458a_200016032200_200000210301 [0,2,0,0,0,0|1,0,0]=3 6406 B12R1.893 CC(=O)c1ccc(c(c1F)Br)F 1458a_100010204296_200000210301 [0,2,0,0,0,0|1,0,0]=3 6407 B12R1.893 CC(=O)c1ccc(c(c1F)C)Br 1458a_100000722919_200000210301 [0,2,0,0,0,0|1,0,0]=3 6408 B12R1.893 CC(=O)c1ccc(c(c1F)C)C 1458a_100010768504_200000210301 [0,2,0,0,0,0|0,0,0]=2 6409 B12R1.893 CC(=O)c1ccc(c(c1F)C)Cl 1458a_100012183103_200000210301 [0,2,0,0,0,0|1,0,0]=3 6410 B12R1.893 CC(=O)c1ccc(c(c1F)C)F 1458a_100000067293_200000210301 [0,2,0,0,0,0|1,0,0]=3 6411 B12R1.893 CC(=O)c1ccc(c(c1F)Cl)Br 1458a_100000719840_200000210301 [0,2,0,0,0,0|1,0,0]=3 6412 B12R1.893 CC(=O)c1ccc(c(c1F)Cl)C 1458a_100000722910_200000210301 [0,2,0,0,0,0|0,0,0]=2 6413 B12R1.893 CC(=O)c1ccc(c(c1F)Cl)F 1458a_100000034381_200000210301 [0,2,0,0,0,0|1,0,0]=3 6414 B12R1.893 CC(=O)c1ccc(c(c1F)F)Br 1458a_100009816880_200000210301 [0,2,0,0,0,0|1,0,0]=3 6415 B12R1.893 CC(=O)c1ccc(c(c1F)F)C 1458a_100011219789_200000210301 [0,2,0,0,0,0|0,0,0]=2 6416 B12R1.893 CC(=O)c1ccc(c(c1F)F)Cl 1458a_100000085317_200000210301 [0,2,0,0,0,0|1,0,0]=3 6417 B12R1.893 CC(=O)c1ccc(c(c1F)F)F 1458a_100000766628_200000210301 [0,2,0,0,0,0|1,0,0]=3 6418 B12R1.893 CC(=O)c1ccc(c(c1F)F)I 1458a_100010177778_200000210301 [0,2,0,0,0,0|1,0,0]=3 6419 B12R1.893 CC(=O)c1ccc(c(c1F)F)O 1458a_100000036740_200000210301 [0,2,0,0,0,0|1,0,0]=3 6420 B12R1.893 CC(=O)c1ccc(c(c1F)F)O 271570a_203496583355_100010174444 [0,2,0,0,0,0|1,0,0]=3 6421 B12R1.893 CC(=O)c1ccc(c(c1F)O)F 1458a_100000084588_200000210301 [0,2,0,0,0,0|1,0,0]=3 6422 B12R1.893 CC(=O)c1ccc(c(c1F)O)F 271570a_203496583355_100010179980 [0,2,0,0,0,0|1,0,0]=3 6423 B12R1.893 CC(=O)c1ccc(c(c1I)C)C 1458a_100010188221_200000210301 [0,2,0,0,0,0|0,0,0]=2 6424 B12R1.893 CC(=O)c1ccc(c(c1O)C)C 1458a_100000742916_200000210301 [0,2,0,0,0,0|0,0,0]=2 6425 B12R1.893 CC(=O)c1ccc(c(c1O)F)Br 1458a_100010761495_200000210301 [0,2,0,0,0,0|1,0,0]=3 6426 B12R1.893 CC(=O)c1ccc(c(c1O)F)F 1458a_100011799213_200000210301 [0,2,0,0,0,0|1,0,0]=3 6427 B12R1.893 CC(=O)c1ccc(c(c1O)F)F 271570a_203496583355_200013857550 [0,2,0,0,0,0|1,0,0]=3 6428 B12R1.893 CC(=O)c1ccc(c(c1O)O)O 1458a_100000037941_200000210301 [0,2,0,0,0,0|1,0,0]=3 6429 B12R1.893 Cc1c(ccc(c1Cl)C(=O)[13CH3])Cl 1458a_100010074829_200025704644 [0,2,0,0,0,0|1,0,0]=3 6430 B12R1.893 Cc1c(ccc(c1Cl)C(=O)[13CH3])F 1458a_100000061447_200025704644 [0,2,0,0,0,0|1,0,0]=3 6431 B12R1.893 Cc1c(ccc(c1F)C(=O)[13CH3])Br 1458a_100000722919_200025704644 [0,2,0,0,0,0|1,0,0]=3 6432 B12R1.893 Cc1c(ccc(c1F)C(=O)[13CH3])Cl 1458a_100012183103_200025704644 [0,2,0,0,0,0|1,0,0]=3 6433 B12R1.893 Cc1c(ccc(c1F)C(=O)[13CH3])F 1458a_100000067293_200025704644 [0,2,0,0,0,0|1,0,0]=3 6434 B12R1.893 Cc1c(ccc(c1F)F)C(=O)[13CH3] 1458a_100000061971_200025704644 [0,2,0,0,0,0|1,0,0]=3 6435 B12R1.893 Cc1ccc(c(c1C)F)C(=O)[13CH3] 1458a_100010768504_200025704644 [0,2,0,0,0,0|0,0,0]=2 6436 B12R1.893 Cc1ccc(c(c1C)I)C(=O)[13CH3] 1458a_100010188221_200025704644 [0,2,0,0,0,0|0,0,0]=2 6437 B12R1.893 Cc1ccc(c(c1C)O)C(=O)[13CH3] 1458a_100000742916_200025704644 [0,2,0,0,0,0|0,0,0]=2 6438 B12R1.893 Cc1ccc(c(c1Cl)F)C(=O)[13CH3] 1458a_100000722910_200025704644 [0,2,0,0,0,0|0,0,0]=2 6439 B12R1.893 Cc1ccc(c(c1F)F)C(=O)[13CH3] 1458a_100011219789_200025704644 [0,2,0,0,0,0|0,0,0]=2 6440 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Br)F)F 1458a_100012356454_200025704644 [0,2,0,0,0,0|1,0,0]=3 6441 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Br)O)Br 1458a_100016068111_200025704644 [0,2,0,0,0,0|1,0,0]=3 6442 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)Br)Cl 1458a_100010208263_200025704644 [0,2,0,0,0,0|1,0,0]=3 6443 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)Cl)Br 1458a_200012347731_200025704644 [0,2,0,0,0,0|1,0,0]=3 6444 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)Cl)F 1458a_100010209669_200025704644 [0,2,0,0,0,0|1,0,0]=3 6445 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)F)Cl 1458a_200010192171_200025704644 [0,2,0,0,0,0|1,0,0]=3 6446 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)F)F 1458a_100009888510_200025704644 [0,2,0,0,0,0|1,0,0]=3 6447 B12R1.893 [13CH3]C(=O)c1ccc(c(c1Cl)O)O 1458a_100009910189_200025704644 [0,2,0,0,0,0|1,0,0]=3 6448 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)Br)Br 1458a_200016032200_200025704644 [0,2,0,0,0,0|1,0,0]=3 6449 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)Br)F 1458a_100010204296_200025704644 [0,2,0,0,0,0|1,0,0]=3 6450 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)Cl)Br 1458a_100000719840_200025704644 [0,2,0,0,0,0|1,0,0]=3 6451 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)Cl)F 1458a_100000034381_200025704644 [0,2,0,0,0,0|1,0,0]=3 6452 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)F)Br 1458a_100009816880_200025704644 [0,2,0,0,0,0|1,0,0]=3 6453 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)F)Cl 1458a_100000085317_200025704644 [0,2,0,0,0,0|1,0,0]=3 6454 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)F)F 1458a_100000766628_200025704644 [0,2,0,0,0,0|1,0,0]=3 6455 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)F)I 1458a_100010177778_200025704644 [0,2,0,0,0,0|1,0,0]=3 6456 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)F)O 1458a_100000036740_200025704644 [0,2,0,0,0,0|1,0,0]=3 6457 B12R1.893 [13CH3]C(=O)c1ccc(c(c1F)O)F 1458a_100000084588_200025704644 [0,2,0,0,0,0|1,0,0]=3 6458 B12R1.893 [13CH3]C(=O)c1ccc(c(c1O)F)Br 1458a_100010761495_200025704644 [0,2,0,0,0,0|1,0,0]=3 6459 B12R1.893 [13CH3]C(=O)c1ccc(c(c1O)F)F 1458a_100011799213_200025704644 [0,2,0,0,0,0|1,0,0]=3 6460 B12R1.893 [13CH3]C(=O)c1ccc(c(c1O)O)O 1458a_100000037941_200025704644 [0,2,0,0,0,0|1,0,0]=3 6461 B12R1.1005 C=C(C)c1cc(c(c(c1)Br)C)Br 271570a_100000694244_100011099977 [0,2,0,0,0,0|1,0,0]=3 6462 B12R1.1005 C=C(C)c1cc(c(c(c1)Br)O)C 271570a_100000694244_100010982682 [0,2,0,0,0,0|2,0,0]=4 6463 B12R1.1005 C=C(C)c1cc(c(c(c1)C)C)C 271570a_100000694244_200011015895 [0,2,0,0,0,0|1,0,0]=3 6464 B12R1.1005 C=C(C)c1cc(c(c(c1)C)F)C 271570a_100000694244_100009814169 [0,2,0,0,0,0|2,0,0]=4 6465 B12R1.1005 C=C(C)c1cc(c(c(c1)C)N)C 271570a_100000694244_100000737279 [0,2,0,0,0,0|2,0,0]=4 6466 B12R1.1005 C=C(C)c1cc(c(c(c1)C)O)C 271570a_100000694244_100000187306 [0,2,0,0,0,0|2,0,0]=4 6467 B12R1.1005 C=C(C)c1cc(c(c(c1)Cl)Br)Cl 271570a_100000694244_200010212260 [0,2,0,0,0,0|2,0,0]=4 6468 B12R1.1005 C=C(C)c1cc(c(c(c1)Cl)F)Cl 271570a_100000694244_100012357505 [0,2,0,0,0,0|2,0,0]=4 6469 B12R1.1005 C=C(C)c1cc(c(c(c1)Cl)O)C 271570a_100000694244_200015900153 [0,2,0,0,0,0|2,0,0]=4 6470 B12R1.1005 C=C(C)c1cc(c(c(c1)Cl)O)Cl 271570a_100000694244_100012339652 [0,2,0,0,0,0|2,0,0]=4 6471 B12R1.1005 C=C(C)c1cc(c(c(c1)F)C)F 271570a_100000694244_100009814309 [0,2,0,0,0,0|1,0,0]=3 6472 B12R1.1005 C=C(C)c1cc(c(c(c1)F)C)N 271570a_100000694244_100009813729 [0,2,0,0,0,0|1,0,0]=3 6473 B12R1.1005 C=C(C)c1cc(c(c(c1)F)Cl)F 271570a_100000694244_100010154629 [0,2,0,0,0,0|2,0,0]=4 6474 B12R1.1005 C=C(C)c1cc(c(c(c1)F)F)C 271570a_100000694244_200011068660 [0,2,0,0,0,0|2,0,0]=4 6475 B12R1.1005 C=C(C)c1cc(c(c(c1)F)F)F 271570a_100000694244_100011215606 [0,2,0,0,0,0|2,0,0]=4 6476 B12R1.1005 C=C(C)c1cc(c(c(c1)F)F)O 271570a_100000694244_100000709865 [0,2,0,0,0,0|2,0,0]=4 6477 B12R1.1005 C=C(C)c1cc(c(c(c1)F)N)C 271570a_100000694244_100000709789 [0,2,0,0,0,0|2,0,0]=4 6478 B12R1.1005 C=C(C)c1cc(c(c(c1)F)N)F 271570a_100000694244_100000758902 [0,2,0,0,0,0|2,0,0]=4 6479 B12R1.1005 C=C(C)c1cc(c(c(c1)F)N)N 271570a_100000694244_100011218333 [0,2,0,0,0,0|2,0,0]=4 6480 B12R1.1005 C=C(C)c1cc(c(c(c1)F)N)O 271570a_100000694244_100015475841 [0,2,0,0,0,0|2,0,0]=4 6481 B12R1.1005 C=C(C)c1cc(c(c(c1)F)O)F 271570a_100000694244_100011216917 [0,2,0,0,0,0|2,0,0]=4 6482 B12R1.1005 C=C(C)c1cc(c(c(c1)F)O)N 271570a_100000694244_100011217383 [0,2,0,0,0,0|2,0,0]=4 6483 B12R1.1005 C=C(C)c1cc(c(c(c1)N)F)C 271570a_100000694244_100010381932 [0,2,0,0,0,0|2,0,0]=4 6484 B12R1.1005 C=C(C)c1cc(c(c(c1)N)N)C 271570a_100000694244_100000688557 [0,2,0,0,0,0|2,0,0]=4 6485 B12R1.1005 C=C(C)c1cc(c(c(c1)N)O)C 271570a_100000694244_100011825904 [0,2,0,0,0,0|2,0,0]=4 6486 B12R1.1005 C=C(C)c1cc(c(c(c1)O)N)C 271570a_100000694244_100010371313 [0,2,0,0,0,0|2,0,0]=4 6487 B12R1.1005 CC(=O)c1cc(c(c(c1)Br)C)Br 1458a_100000187602_200000210301 [0,2,0,0,0,0|0,0,0]=2 6488 B12R1.1005 CC(=O)c1cc(c(c(c1)Br)C)F 1458a_200012347618_200000210301 [0,2,0,0,0,0|0,0,0]=2 6489 B12R1.1005 CC(=O)c1cc(c(c(c1)Br)Cl)Cl 1458a_200012920480_200000210301 [0,2,0,0,0,0|1,0,0]=3 6490 B12R1.1005 CC(=O)c1cc(c(c(c1)Br)Cl)F 1458a_100010291025_200000210301 [0,2,0,0,0,0|1,0,0]=3 6491 B12R1.1005 CC(=O)c1cc(c(c(c1)Br)F)F 1458a_100010259547_200000210301 [0,2,0,0,0,0|1,0,0]=3 6492 B12R1.1005 CC(=O)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_200000210301 [0,2,0,0,0,0|1,0,0]=3 6493 B12R1.1005 CC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_200000210301 [0,2,0,0,0,0|1,0,0]=3 6494 B12R1.1005 CC(=O)c1cc(c(c(c1)C)Br)C 1458a_100000700660_200000210301 [0,2,0,0,0,0|1,0,0]=3 6495 B12R1.1005 CC(=O)c1cc(c(c(c1)C)C)C 1458a_100000075298_200000210301 [0,2,0,0,0,0|0,0,0]=2 6496 B12R1.1005 CC(=O)c1cc(c(c(c1)C)Cl)C 1458a_100000102532_200000210301 [0,2,0,0,0,0|1,0,0]=3 6497 B12R1.1005 CC(=O)c1cc(c(c(c1)C)F)C 1458a_100000741972_200000210301 [0,2,0,0,0,0|1,0,0]=3 6498 B12R1.1005 CC(=O)c1cc(c(c(c1)C)I)C 1458a_100010769667_200000210301 [0,2,0,0,0,0|1,0,0]=3 6499 B12R1.1005 CC(=O)c1cc(c(c(c1)C)O)C 1458a_100011219978_200000210301 [0,2,0,0,0,0|1,0,0]=3 6500 B12R1.1005 CC(=O)c1cc(c(c(c1)Cl)Br)Cl 1458a_100012354307_200000210301 [0,2,0,0,0,0|1,0,0]=3 6501 B12R1.1005 CC(=O)c1cc(c(c(c1)Cl)C)Cl 1458a_100012356007_200000210301 [0,2,0,0,0,0|0,0,0]=2 6502 B12R1.1005 CC(=O)c1cc(c(c(c1)Cl)Cl)Cl 1458a_100012339221_200000210301 [0,2,0,0,0,0|1,0,0]=3 6503 B12R1.1005 CC(=O)c1cc(c(c(c1)Cl)Cl)F 1458a_200010244527_200000210301 [0,2,0,0,0,0|1,0,0]=3 6504 B12R1.1005 CC(=O)c1cc(c(c(c1)Cl)F)Cl 1458a_100011934374_200000210301 [0,2,0,0,0,0|1,0,0]=3 6505 B12R1.1005 CC(=O)c1cc(c(c(c1)Cl)F)F 1458a_100000068011_200000210301 [0,2,0,0,0,0|1,0,0]=3 6506 B12R1.1005 CC(=O)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_200000210301 [0,2,0,0,0,0|1,0,0]=3 6507 B12R1.1005 CC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_200000210301 [0,2,0,0,0,0|1,0,0]=3 6508 B12R1.1005 CC(=O)c1cc(c(c(c1)F)Br)F 1458a_100010078405_200000210301 [0,2,0,0,0,0|1,0,0]=3 6509 B12R1.1005 CC(=O)c1cc(c(c(c1)F)C)F 1458a_100000055762_200000210301 [0,2,0,0,0,0|0,0,0]=2 6510 B12R1.1005 CC(=O)c1cc(c(c(c1)F)Cl)F 1458a_100000104779_200000210301 [0,2,0,0,0,0|1,0,0]=3 6511 B12R1.1005 CC(=O)c1cc(c(c(c1)F)F)C 1458a_100000061453_200000210301 [0,2,0,0,0,0|1,0,0]=3 6512 B12R1.1005 CC(=O)c1cc(c(c(c1)F)F)F 1458a_100000751656_200000210301 [0,2,0,0,0,0|1,0,0]=3 6513 B12R1.1005 CC(=O)c1cc(c(c(c1)F)F)O 1458a_200000081825_200000210301 [0,2,0,0,0,0|1,0,0]=3 6514 B12R1.1005 CC(=O)c1cc(c(c(c1)F)O)F 1458a_100000766045_200000210301 [0,2,0,0,0,0|1,0,0]=3 6515 B12R1.1005 CC(=O)c1cc(c(c(c1)F)O)F 271570a_203496583355_100010371124 [0,2,0,0,0,0|1,0,0]=3 6516 B12R1.1005 CC(=O)c1cc(c(c(c1)I)C)F 1458a_100012344050_200000210301 [0,2,0,0,0,0|0,0,0]=2 6517 B12R1.1005 CC(=O)c1cc(c(c(c1)I)I)I 1458a_100000033816_200000210301 [0,2,0,0,0,0|1,0,0]=3 6518 B12R1.1005 CC(=O)c1cc(c(c(c1)I)O)I 1458a_100000034356_200000210301 [0,2,0,0,0,0|1,0,0]=3 6519 B12R1.1005 CC(=O)c1cc(c(c(c1)O)C)O 1458a_100000031928_200000210301 [0,2,0,0,0,0|0,0,0]=2 6520 B12R1.1005 CC(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_200000210301 [0,2,0,0,0,0|1,0,0]=3 6521 B12R1.1005 CC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_200000210301 [0,2,0,0,0,0|1,0,0]=3 6522 B12R1.1005 Cc1c(cc(cc1Br)C(=O)[13CH3])Br 1458a_100000187602_200025704644 [0,2,0,0,0,0|0,0,0]=2 6523 B12R1.1005 Cc1c(cc(cc1Br)C(=O)[13CH3])F 1458a_200012347618_200025704644 [0,2,0,0,0,0|0,0,0]=2 6524 B12R1.1005 Cc1c(cc(cc1Cl)C(=O)[13CH3])Cl 1458a_100012356007_200025704644 [0,2,0,0,0,0|0,0,0]=2 6525 B12R1.1005 Cc1c(cc(cc1F)C(=O)[13CH3])F 1458a_100000055762_200025704644 [0,2,0,0,0,0|0,0,0]=2 6526 B12R1.1005 Cc1c(cc(cc1I)C(=O)[13CH3])F 1458a_100012344050_200025704644 [0,2,0,0,0,0|0,0,0]=2 6527 B12R1.1005 Cc1c(cc(cc1O)C(=O)[13CH3])O 1458a_100000031928_200025704644 [0,2,0,0,0,0|0,0,0]=2 6528 B12R1.1005 Cc1cc(cc(c1Br)C)C(=O)[13CH3] 1458a_100000700660_200025704644 [0,2,0,0,0,0|1,0,0]=3 6529 B12R1.1005 Cc1cc(cc(c1C)C)C(=O)[13CH3] 1458a_100000075298_200025704644 [0,2,0,0,0,0|0,0,0]=2 6530 B12R1.1005 Cc1cc(cc(c1Cl)C)C(=O)[13CH3] 1458a_100000102532_200025704644 [0,2,0,0,0,0|1,0,0]=3 6531 B12R1.1005 Cc1cc(cc(c1F)C)C(=O)[13CH3] 1458a_100000741972_200025704644 [0,2,0,0,0,0|1,0,0]=3 6532 B12R1.1005 Cc1cc(cc(c1F)F)C(=O)[13CH3] 1458a_100000061453_200025704644 [0,2,0,0,0,0|1,0,0]=3 6533 B12R1.1005 Cc1cc(cc(c1I)C)C(=O)[13CH3] 1458a_100010769667_200025704644 [0,2,0,0,0,0|1,0,0]=3 6534 B12R1.1005 Cc1cc(cc(c1O)C)C(=O)N 271570a_203496583355_200009816865 [0,2,0,0,0,0|2,0,0]=4 6535 B12R1.1005 Cc1cc(cc(c1O)C)C(=O)[13CH3] 1458a_100011219978_200025704644 [0,2,0,0,0,0|1,0,0]=3 6536 B12R1.1005 NC(=O)c1cc(c(c(c1)O)O)O 271570a_203496583355_200009814324 [0,2,0,0,0,0|2,0,0]=4 6537 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Br)Cl)Cl 1458a_200012920480_200025704644 [0,2,0,0,0,0|1,0,0]=3 6538 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Br)Cl)F 1458a_100010291025_200025704644 [0,2,0,0,0,0|1,0,0]=3 6539 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Br)F)F 1458a_100010259547_200025704644 [0,2,0,0,0,0|1,0,0]=3 6540 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Br)O)Br 1458a_100000692688_200025704644 [0,2,0,0,0,0|1,0,0]=3 6541 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_200025704644 [0,2,0,0,0,0|1,0,0]=3 6542 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Cl)Br)Cl 1458a_100012354307_200025704644 [0,2,0,0,0,0|1,0,0]=3 6543 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Cl)Cl)Cl 1458a_100012339221_200025704644 [0,2,0,0,0,0|1,0,0]=3 6544 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Cl)Cl)F 1458a_200010244527_200025704644 [0,2,0,0,0,0|1,0,0]=3 6545 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Cl)F)Cl 1458a_100011934374_200025704644 [0,2,0,0,0,0|1,0,0]=3 6546 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Cl)F)F 1458a_100000068011_200025704644 [0,2,0,0,0,0|1,0,0]=3 6547 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Cl)O)Cl 1458a_100000184433_200025704644 [0,2,0,0,0,0|1,0,0]=3 6548 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_200025704644 [0,2,0,0,0,0|1,0,0]=3 6549 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)F)Br)F 1458a_100010078405_200025704644 [0,2,0,0,0,0|1,0,0]=3 6550 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)F)Cl)F 1458a_100000104779_200025704644 [0,2,0,0,0,0|1,0,0]=3 6551 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)F)F)F 1458a_100000751656_200025704644 [0,2,0,0,0,0|1,0,0]=3 6552 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)F)F)O 1458a_200000081825_200025704644 [0,2,0,0,0,0|1,0,0]=3 6553 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)F)O)F 1458a_100000766045_200025704644 [0,2,0,0,0,0|1,0,0]=3 6554 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)I)I)I 1458a_100000033816_200025704644 [0,2,0,0,0,0|1,0,0]=3 6555 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)I)O)I 1458a_100000034356_200025704644 [0,2,0,0,0,0|1,0,0]=3 6556 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)O)Cl)O 1458a_100000074654_200025704644 [0,2,0,0,0,0|1,0,0]=3 6557 B12R1.1005 [13CH3]C(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_200025704644 [0,2,0,0,0,0|1,0,0]=3 6558 B12R1.12 CCC(NC)c1ccc(cc1)C 2230a_100000749201_200000210301 [0,2,0,0,0,0|1,0,1]=4 6559 B12R1.12 CCC(NC)c1ccc(cc1)C 269862a_106832991636_100000185863 [0,2,0,0,0,0|1,0,1]=4 6560 B12R1.12 CCC(NC)c1ccc(cc1)C 34a_100000749201_200000210301 [0,2,0,0,0,0|1,0,1]=4 6561 B12R1.12 CCC(N[13CH3])c1ccc(cc1)C 2230a_100000749201_200025704644 [0,2,0,0,0,0|1,0,1]=4 6562 B12R1.12 CCC(N[13CH3])c1ccc(cc1)C 34a_100000749201_200025704644 [0,2,0,0,0,0|1,0,1]=4 6563 B12R1.12 CCC(OC)c1ccc(cc1)C 34a_100000246521_200000210301 [0,2,0,0,0,0|0,0,2]=4 6564 B12R1.12 CCC(OC)c1ccc(cc1)C 7a_100000246521_200000210301 [0,2,0,0,0,0|0,0,2]=4 6565 B12R1.12 CCC(O[13CH3])c1ccc(cc1)C 34a_100000246521_200025704644 [0,2,0,0,0,0|0,0,2]=4 6566 B12R1.12 CCC(O[13CH3])c1ccc(cc1)C 7a_100000246521_200025704644 [0,2,0,0,0,0|0,0,2]=4 6567 B12R1.12 CCN(CC)c1ccc(cc1)C 2230a_100000219985_100000210202 [0,2,0,0,0,0|2,0,0]=4 6568 B12R1.12 CCN(CC)c1ccc(cc1)C 269982a_100000219985_100000204670 [0,2,0,0,0,0|2,0,0]=4 6569 B12R1.12 CCN(CC)c1ccc(cc1)C 34a_100000219985_100000210202 [0,2,0,0,0,0|2,0,0]=4 6570 B12R1.12 CCN(CF)c1ccc(cc1)C 269982a_100000219985_100015361967 [0,2,0,0,0,0|2,0,0]=4 6571 B12R1.12 CCN(CF)c1ccc(cc1)C 34a_100000219985_100015361967 [0,2,0,0,0,0|2,0,0]=4 6572 B12R1.12 CN[C@@H](CO)c1ccc(cc1)C 2230a_100009818840_200000210301 [0,2,0,0,0,0|0,0,2]=4 6573 B12R1.12 CN[C@@H](CO)c1ccc(cc1)C 34a_100009818840_200000210301 [0,2,0,0,0,0|0,0,2]=4 6574 B12R1.12 CO[C@@H](C#N)c1ccc(cc1)C 34a_200009814964_200000210301 [0,2,0,0,0,0|1,0,1]=4 6575 B12R1.12 CO[C@@H](C#N)c1ccc(cc1)C 7a_200009814964_200000210301 [0,2,0,0,0,0|1,0,1]=4 6576 B12R1.12 Cc1ccc(cc1)[C@H](C#N)O[13CH3] 34a_200009814964_200025704644 [0,2,0,0,0,0|1,0,1]=4 6577 B12R1.12 Cc1ccc(cc1)[C@H](C#N)O[13CH3] 7a_200009814964_200025704644 [0,2,0,0,0,0|1,0,1]=4 6578 B12R1.12 Cc1ccc(cc1)[C@H](CO)N[13CH3] 2230a_100009818840_200025704644 [0,2,0,0,0,0|0,0,2]=4 6579 B12R1.12 Cc1ccc(cc1)[C@H](CO)N[13CH3] 34a_100009818840_200025704644 [0,2,0,0,0,0|0,0,2]=4 6580 B12R1.16 C#CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000184674 [0,2,0,0,0,0|1,0,0]=3 6581 B12R1.16 C#CCC(=O)c1ccc(cc1)C 1458a_100000188618_100000184674 [0,2,0,0,0,0|0,0,0]=2 6582 B12R1.16 C#CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000184674 [0,2,0,0,0,0|1,0,0]=3 6583 B12R1.16 C#CCC(=O)c1ccc(cc1)F 1458a_100000187176_100000184674 [0,2,0,0,0,0|1,0,0]=3 6584 B12R1.16 C#CCC(=O)c1ccc(cc1)I 1458a_100000187904_100000184674 [0,2,0,0,0,0|1,0,0]=3 6585 B12R1.16 C#CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000184674 [0,2,0,0,0,0|1,0,0]=3 6586 B12R1.16 C#CCN(C)c1ccc(cc1)C 2230a_100000219977_100000038162 [0,2,0,0,0,0|2,0,0]=4 6587 B12R1.16 C#CCN(C)c1ccc(cc1)C 34a_100000219977_100000184674 [0,2,0,0,0,0|2,0,0]=4 6588 B12R1.16 C=CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210623 [0,2,0,0,0,0|1,0,0]=3 6589 B12R1.16 C=CCC(=O)c1ccc(cc1)C 1458a_100000188618_100000210623 [0,2,0,0,0,0|0,0,0]=2 6590 B12R1.16 C=CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210623 [0,2,0,0,0,0|1,0,0]=3 6591 B12R1.16 C=CCC(=O)c1ccc(cc1)F 1458a_100000187176_100000210623 [0,2,0,0,0,0|1,0,0]=3 6592 B12R1.16 C=CCC(=O)c1ccc(cc1)I 1458a_100000187904_100000210623 [0,2,0,0,0,0|1,0,0]=3 6593 B12R1.16 C=CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210623 [0,2,0,0,0,0|1,0,0]=3 6594 B12R1.16 C=CCN(C)c1ccc(cc1)C 2230a_100000219977_100000210623 [0,2,0,0,0,0|2,0,0]=4 6595 B12R1.16 C=CCN(C)c1ccc(cc1)C 269982a_100000219977_100000210623 [0,2,0,0,0,0|2,0,0]=4 6596 B12R1.16 C=CCN(C)c1ccc(cc1)C 34a_100000219977_100015514636 [0,2,0,0,0,0|2,0,0]=4 6597 B12R1.16 CC#CC(=O)c1ccc(cc1)O 271570a_203496583355_100153741113 [0,2,0,0,0,0|1,0,0]=3 6598 B12R1.16 CCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210303 [0,2,0,0,0,0|1,0,0]=3 6599 B12R1.16 CCCC(=O)c1ccc(cc1)C 1458a_100000188618_100000210303 [0,2,0,0,0,0|0,0,0]=2 6600 B12R1.16 CCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210303 [0,2,0,0,0,0|1,0,0]=3 6601 B12R1.16 CCCC(=O)c1ccc(cc1)F 1458a_100000187176_100000210303 [0,2,0,0,0,0|1,0,0]=3 6602 B12R1.16 CCCC(=O)c1ccc(cc1)I 1458a_100000187904_100000210303 [0,2,0,0,0,0|1,0,0]=3 6603 B12R1.16 CCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210303 [0,2,0,0,0,0|1,0,0]=3 6604 B12R1.16 CCCC(=O)c1ccc(cc1)O 271570a_203496583355_100011267722 [0,2,0,0,0,0|1,0,0]=3 6605 B12R1.16 CCCC(=O)c1ccc(nc1)O 271570a_203496583355_200012185933 [0,2,0,0,0,0|2,0,0]=4 6606 B12R1.16 CCCN(C)c1ccc(cc1)C 2230a_100000219977_100000210303 [0,2,0,0,0,0|2,0,0]=4 6607 B12R1.16 CCCN(C)c1ccc(cc1)C 269982a_100000219977_100000210303 [0,2,0,0,0,0|2,0,0]=4 6608 B12R1.16 CCCN(C)c1ccc(cc1)C 34a_100000219977_100000210303 [0,2,0,0,0,0|2,0,0]=4 6609 B12R1.16 CCNC(=O)c1ccc(cc1)Br 11a_100015525214_100000185839 [0,2,0,0,0,0|1,0,0]=3 6610 B12R1.16 CCNC(=O)c1ccc(cc1)Br 240690a_100015525214_100000185839 [0,2,0,0,0,0|1,0,0]=3 6611 B12R1.16 CCNC(=O)c1ccc(cc1)Br 527a_100015525214_100000185839 [0,2,0,0,0,0|1,0,0]=3 6612 B12R1.16 CCNC(=O)c1ccc(cc1)C 11a_100015525214_100000188618 [0,2,0,0,0,0|0,0,0]=2 6613 B12R1.16 CCNC(=O)c1ccc(cc1)C 240690a_100015525214_100000188618 [0,2,0,0,0,0|0,0,0]=2 6614 B12R1.16 CCNC(=O)c1ccc(cc1)C 527a_100015525214_100000188618 [0,2,0,0,0,0|0,0,0]=2 6615 B12R1.16 CCNC(=O)c1ccc(cc1)Cl 11a_100015525214_100000210187 [0,2,0,0,0,0|1,0,0]=3 6616 B12R1.16 CCNC(=O)c1ccc(cc1)Cl 240690a_100015525214_100000210187 [0,2,0,0,0,0|1,0,0]=3 6617 B12R1.16 CCNC(=O)c1ccc(cc1)Cl 527a_100015525214_100000210187 [0,2,0,0,0,0|1,0,0]=3 6618 B12R1.16 CCNC(=O)c1ccc(cc1)F 11a_100015525214_100000187176 [0,2,0,0,0,0|1,0,0]=3 6619 B12R1.16 CCNC(=O)c1ccc(cc1)F 240690a_100015525214_100000187176 [0,2,0,0,0,0|1,0,0]=3 6620 B12R1.16 CCNC(=O)c1ccc(cc1)F 527a_100015525214_100000187176 [0,2,0,0,0,0|1,0,0]=3 6621 B12R1.16 CCNC(=O)c1ccc(cc1)I 11a_100015525214_100000187904 [0,2,0,0,0,0|1,0,0]=3 6622 B12R1.16 CCNC(=O)c1ccc(cc1)I 240690a_100015525214_100000187904 [0,2,0,0,0,0|1,0,0]=3 6623 B12R1.16 CCNC(=O)c1ccc(cc1)I 527a_100015525214_100000187904 [0,2,0,0,0,0|1,0,0]=3 6624 B12R1.16 CCNC(=O)c1ccc(cc1)O 240690a_100015525214_100000212099 [0,2,0,0,0,0|1,0,0]=3 6625 B12R1.16 CCNC(=O)c1ccc(cc1)O 271570a_203496583355_100000155177 [0,2,0,0,0,0|1,0,0]=3 6626 B12R1.16 CCNC(=O)c1ccc(cc1)O 527a_100015525214_100000212099 [0,2,0,0,0,0|1,0,0]=3 6627 B12R1.16 CCNC(=O)c1ccc(cn1)O 271570a_203496583355_200011781264 [0,2,0,0,0,0|2,0,0]=4 6628 B12R1.16 CCNC(=O)c1ccc(nc1)O 271570a_203496583355_100000160145 [0,2,0,0,0,0|2,0,0]=4 6629 B12R1.16 CCNC(C)c1ccc(cc1)C 2230a_100015525214_100011261388 [0,2,0,0,0,0|1,0,1]=4 6630 B12R1.16 CCNC(C)c1ccc(cc1)C 269862a_100015525214_100000185793 [0,2,0,0,0,0|1,0,1]=4 6631 B12R1.16 CCN[C@H](C)c1ccc(cc1)C 2230a_100016988085_100000210202 [0,2,0,0,0,0|1,0,1]=4 6632 B12R1.16 CCN[C@H](C)c1ccc(cc1)C 34a_100016988085_100000210202 [0,2,0,0,0,0|1,0,1]=4 6633 B12R1.16 CCOC(=O)c1ccc(cc1)O 271570a_203496583355_100000170077 [0,2,0,0,0,0|1,0,0]=3 6634 B12R1.16 CCOC(=O)c1ccc(cn1)O 271570a_203496583355_100011781174 [0,2,0,0,0,0|2,0,0]=4 6635 B12R1.16 CCOC(=O)c1ccc(nc1)O 271570a_203496583355_100000170224 [0,2,0,0,0,0|2,0,0]=4 6636 B12R1.16 CCOC(C)c1ccc(cc1)C 34a_100121572206_100011261388 [0,2,0,0,0,0|0,0,2]=4 6637 B12R1.16 CCO[C@H](C)c1ccc(cc1)C 34a_100000690690_100000210202 [0,2,0,0,0,0|0,0,2]=4 6638 B12R1.16 CCO[C@H](C)c1ccc(cc1)C 7a_100000690690_100000210202 [0,2,0,0,0,0|0,0,2]=4 6639 B12R1.16 CCSC(C)c1ccc(cc1)C 62a_100000210202_100011261388 [0,2,0,0,0,0|0,1,1]=4 6640 B12R1.16 CCSC(C)c1ccc(cc1)C 62a_100011261388_100000210202 [0,2,0,0,0,0|0,1,1]=4 6641 B12R1.16 CN(CC=O)c1ccc(cc1)Br 2230a_100000219623_200015260668 [0,2,0,0,0,0|2,0,0]=4 6642 B12R1.16 CN(CC=O)c1ccc(cc1)Br 269982a_100000219623_200015260668 [0,2,0,0,0,0|2,0,0]=4 6643 B12R1.16 CN(CC=O)c1ccc(cc1)Br 34a_100000219623_200009817547 [0,2,0,0,0,0|2,0,0]=4 6644 B12R1.16 CN(CC=O)c1ccc(cc1)Cl 2230a_100020629279_200015260668 [0,2,0,0,0,0|2,0,0]=4 6645 B12R1.16 CN(CC=O)c1ccc(cc1)Cl 269982a_100020629279_200015260668 [0,2,0,0,0,0|2,0,0]=4 6646 B12R1.16 CN(CC=O)c1ccc(cc1)Cl 34a_100020629279_200009817547 [0,2,0,0,0,0|2,0,0]=4 6647 B12R1.16 CN(CC=O)c1ccc(cc1)F 2230a_100000219829_200015260668 [0,2,0,0,0,0|2,0,0]=4 6648 B12R1.16 CN(CC=O)c1ccc(cc1)F 269982a_100000219829_200015260668 [0,2,0,0,0,0|2,0,0]=4 6649 B12R1.16 CN(CC=O)c1ccc(cc1)F 34a_100000219829_200009817547 [0,2,0,0,0,0|2,0,0]=4 6650 B12R1.16 CN(CC=O)c1ccc(cc1)I 2230a_100000743151_200015260668 [0,2,0,0,0,0|2,0,0]=4 6651 B12R1.16 CN(CC=O)c1ccc(cc1)I 269982a_100000743151_200015260668 [0,2,0,0,0,0|2,0,0]=4 6652 B12R1.16 CN(CC=O)c1ccc(cc1)I 34a_100000743151_200009817547 [0,2,0,0,0,0|2,0,0]=4 6653 B12R1.16 CN(CC=O)c1ccc(cc1)O 269982a_100000182112_200015260668 [0,2,0,0,0,0|2,0,0]=4 6654 B12R1.16 CN(CC=O)c1ccc(cc1)O 34a_100000182112_200009817547 [0,2,0,0,0,0|2,0,0]=4 6655 B12R1.16 CNCC(=O)c1ccc(cc1)Br 34a_100102657272_100000188085 [0,2,0,0,0,0|1,0,0]=3 6656 B12R1.16 CNCC(=O)c1ccc(cc1)Br 7a_106832991635_100000188085 [0,2,0,0,0,0|1,0,0]=3 6657 B12R1.16 CNCC(=O)c1ccc(cc1)C 2230a_106832991635_100000211441 [0,2,0,0,0,0|0,0,0]=2 6658 B12R1.16 CNCC(=O)c1ccc(cc1)C 34a_100102657272_100000211441 [0,2,0,0,0,0|0,0,0]=2 6659 B12R1.16 CNCC(=O)c1ccc(cc1)C 7a_106832991635_100000211441 [0,2,0,0,0,0|0,0,0]=2 6660 B12R1.16 CNCC(=O)c1ccc(cc1)Cl 7a_106832991635_100000211071 [0,2,0,0,0,0|1,0,0]=3 6661 B12R1.16 CNCC(=O)c1ccc(cc1)F 7a_106832991635_100000211279 [0,2,0,0,0,0|1,0,0]=3 6662 B12R1.16 CNCC(=O)c1ccc(cc1)I 34a_100102657272_100011216261 [0,2,0,0,0,0|1,0,0]=3 6663 B12R1.16 CNCC(=O)c1ccc(cc1)I 7a_106832991635_100011216261 [0,2,0,0,0,0|1,0,0]=3 6664 B12R1.16 CNCC(=O)c1ccc(cc1)O 34a_100102657272_100009814261 [0,2,0,0,0,0|1,0,0]=3 6665 B12R1.16 CNCC(=O)c1ccc(cc1)O 7a_106832991635_100000018856 [0,2,0,0,0,0|1,0,0]=3 6666 B12R1.16 CNCC(=O)c1ccc(cn1)Cl 7a_106832991635_100016989621 [0,2,0,0,0,0|2,0,0]=4 6667 B12R1.16 CNCC(O)c1ccc(cc1)C 2230a_200020610344_200000210301 [0,2,0,0,0,0|0,0,2]=4 6668 B12R1.16 CNCC(O)c1ccc(cc1)C 34a_200020610344_200000210301 [0,2,0,0,0,0|0,0,2]=4 6669 B12R1.16 CNNC(=O)c1ccc(cc1)Br 22a_100016993582_100000185839 [0,2,0,0,0,0|1,0,0]=3 6670 B12R1.16 CNNC(=O)c1ccc(cc1)C 22a_100016993582_100000188618 [0,2,0,0,0,0|0,0,0]=2 6671 B12R1.16 CNNC(=O)c1ccc(cc1)Cl 22a_100016993582_100000210187 [0,2,0,0,0,0|1,0,0]=3 6672 B12R1.16 CNNC(=O)c1ccc(cc1)F 22a_100016993582_100000187176 [0,2,0,0,0,0|1,0,0]=3 6673 B12R1.16 CNNC(=O)c1ccc(cc1)I 22a_100016993582_100000187904 [0,2,0,0,0,0|1,0,0]=3 6674 B12R1.16 CNNC(=O)c1ccc(cc1)O 22a_100016993582_100000212099 [0,2,0,0,0,0|1,0,0]=3 6675 B12R1.16 COCC(=O)c1ccc(cc1)Br 34a_100138415774_100000188085 [0,2,0,0,0,0|1,0,0]=3 6676 B12R1.16 COCC(=O)c1ccc(cc1)C 34a_100138415774_100000211441 [0,2,0,0,0,0|0,0,0]=2 6677 B12R1.16 COCC(=O)c1ccc(cc1)F 34a_100000246311_200000210301 [0,2,0,0,0,0|1,0,0]=3 6678 B12R1.16 COCC(=O)c1ccc(cc1)I 34a_100138415774_100011216261 [0,2,0,0,0,0|1,0,0]=3 6679 B12R1.16 COCC(=O)c1ccc(cc1)O 271570a_203496583355_200011343064 [0,2,0,0,0,0|1,0,0]=3 6680 B12R1.16 COCC(=O)c1ccc(cc1)O 34a_100138415774_100009814261 [0,2,0,0,0,0|1,0,0]=3 6681 B12R1.16 COCN(C)c1ccc(cc1)C 2230a_100000219977_100000766300 [0,2,0,0,0,0|1,0,1]=4 6682 B12R1.16 COCN(C)c1ccc(cc1)C 269982a_100000219977_100000766300 [0,2,0,0,0,0|1,0,1]=4 6683 B12R1.16 COC[C@H](N)c1ccc(cc1)C 34a_100009818840_200000210301 [0,2,0,0,0,0|1,0,1]=4 6684 B12R1.16 CSCC(=O)c1ccc(cc1)Br 62a_100000188085_200000210301 [0,2,0,0,0,0|1,0,0]=3 6685 B12R1.16 CSCC(=O)c1ccc(cc1)C 62a_100000211441_200000210301 [0,2,0,0,0,0|0,0,0]=2 6686 B12R1.16 CSCC(=O)c1ccc(cc1)C 62a_200000210301_100000211441 [0,2,0,0,0,0|0,0,0]=2 6687 B12R1.16 CSCC(=O)c1ccc(cc1)Cl 62a_100000211071_200000210301 [0,2,0,0,0,0|1,0,0]=3 6688 B12R1.16 CSCC(=O)c1ccc(cc1)Cl 62a_200000210301_100000211071 [0,2,0,0,0,0|1,0,0]=3 6689 B12R1.16 CSCC(=O)c1ccc(cc1)F 62a_100000211279_200000210301 [0,2,0,0,0,0|1,0,0]=3 6690 B12R1.16 CSCC(=O)c1ccc(cc1)F 62a_200000210301_100000211279 [0,2,0,0,0,0|1,0,0]=3 6691 B12R1.16 CSCC(=O)c1ccc(cc1)I 62a_100011216261_200000210301 [0,2,0,0,0,0|1,0,0]=3 6692 B12R1.16 CSCC(=O)c1ccc(cc1)I 62a_200000210301_100011216261 [0,2,0,0,0,0|1,0,0]=3 6693 B12R1.16 CSCC(=O)c1ccc(cc1)O 62a_100009814261_200000210301 [0,2,0,0,0,0|1,0,0]=3 6694 B12R1.16 CSCC(=O)c1ccc(cc1)O 62a_200000210301_100009814261 [0,2,0,0,0,0|1,0,0]=3 6695 B12R1.16 CSCC(=O)c1ccc(cn1)Cl 62a_100016989621_200000210301 [0,2,0,0,0,0|2,0,0]=4 6696 B12R1.16 CSCC(=O)c1ccc(cn1)Cl 62a_200000210301_100016989621 [0,2,0,0,0,0|2,0,0]=4 6697 B12R1.16 CSCC(=O)c1ccc(nc1)C 62a_100012027583_200000210301 [0,2,0,0,0,0|1,0,0]=3 6698 B12R1.16 CSCC(=O)c1ccc(nc1)C 62a_200000210301_100012027583 [0,2,0,0,0,0|1,0,0]=3 6699 B12R1.16 CSCC(=O)c1ccc(nc1)Cl 62a_100009864725_200000210301 [0,2,0,0,0,0|2,0,0]=4 6700 B12R1.16 CSCC(=O)c1ccc(nc1)Cl 62a_200000210301_100009864725 [0,2,0,0,0,0|2,0,0]=4 6701 B12R1.16 CSCN(C)c1ccc(cc1)C 2230a_100000219977_100011218213 [0,2,0,0,0,0|1,1,0]=4 6702 B12R1.16 CSCN(C)c1ccc(cc1)C 269982a_100000219977_100011218213 [0,2,0,0,0,0|1,1,0]=4 6703 B12R1.16 CSCN(C)c1ccc(cc1)C 34a_100000219977_100011218213 [0,2,0,0,0,0|1,1,0]=4 6704 B12R1.16 Cc1ccc(cc1)C(=O)CC#N 1458a_100000188618_100011214920 [0,2,0,0,0,0|0,0,0]=2 6705 B12R1.16 Cc1ccc(cc1)C(=O)CCF 1458a_100000188618_100011217306 [0,2,0,0,0,0|0,0,0]=2 6706 B12R1.16 Cc1ccc(cc1)C(=O)CCO 1458a_100000188618_100000211926 [0,2,0,0,0,0|0,0,0]=2 6707 B12R1.16 Cc1ccc(cc1)C(=O)CS[13CH3] 62a_100000211441_200025704644 [0,2,0,0,0,0|0,0,0]=2 6708 B12R1.16 Cc1ccc(cc1)C(=O)CS[13CH3] 62a_200025704644_100000211441 [0,2,0,0,0,0|0,0,0]=2 6709 B12R1.16 Cc1ccc(cc1)C(C)SCF 62a_100011261388_100015361967 [0,2,0,0,0,0|0,1,1]=4 6710 B12R1.16 Cc1ccc(cc1)C(C)SCF 62a_100015361967_100011261388 [0,2,0,0,0,0|0,1,1]=4 6711 B12R1.16 Cc1ccc(cc1)C(O)CN[13CH3] 2230a_200020610344_200025704644 [0,2,0,0,0,0|0,0,2]=4 6712 B12R1.16 Cc1ccc(cc1)C(O)CN[13CH3] 34a_200020610344_200025704644 [0,2,0,0,0,0|0,0,2]=4 6713 B12R1.16 Cc1ccc(cc1)N(C)CC#N 2230a_100000219977_100011215382 [0,2,0,0,0,0|2,0,0]=4 6714 B12R1.16 Cc1ccc(cc1)N(C)CC#N 269982a_100000219977_100011214920 [0,2,0,0,0,0|2,0,0]=4 6715 B12R1.16 Cc1ccc(cc1)N(C)CC=O 2230a_100000219977_200015260668 [0,2,0,0,0,0|1,0,0]=3 6716 B12R1.16 Cc1ccc(cc1)N(C)CC=O 269982a_100000219977_200015260668 [0,2,0,0,0,0|1,0,0]=3 6717 B12R1.16 Cc1ccc(cc1)N(C)CC=O 34a_100000219977_200009817547 [0,2,0,0,0,0|1,0,0]=3 6718 B12R1.16 Cc1ccc(cc1)N(C)CCF 2230a_100000219977_100011217306 [0,2,0,0,0,0|2,0,0]=4 6719 B12R1.16 Cc1ccc(cc1)N(C)CCF 269982a_100000219977_100011217306 [0,2,0,0,0,0|2,0,0]=4 6720 B12R1.16 Cc1ccc(cc1)N(C)CCF 34a_100000219977_100011217306 [0,2,0,0,0,0|2,0,0]=4 6721 B12R1.16 Cc1ccc(cc1)N(C)CCO 2230a_100000219977_100000211926 [0,2,0,0,0,0|1,0,1]=4 6722 B12R1.16 Cc1ccc(cc1)N(C)CCO 269982a_100000219977_100000211926 [0,2,0,0,0,0|1,0,1]=4 6723 B12R1.16 Cc1ccc(cc1)N(C)CCO 34a_100000219977_100000211926 [0,2,0,0,0,0|1,0,1]=4 6724 B12R1.16 Cc1ccc(cc1)[C@@H](C)NCF 34a_100016988085_100015361967 [0,2,0,0,0,0|1,0,1]=4 6725 B12R1.16 Cc1ccc(cc1)[C@@H](C)OCF 34a_100000690690_100015361967 [0,2,0,0,0,0|0,0,2]=4 6726 B12R1.16 Cc1ccc(cc1)[C@@H](C)OCF 7a_100000690690_100015361967 [0,2,0,0,0,0|0,0,2]=4 6727 B12R1.16 Cc1ccc(cc1)[C@@H](N)CO[13CH3] 34a_100009818840_200025704644 [0,2,0,0,0,0|1,0,1]=4 6728 B12R1.16 Cc1ccc(cn1)C(=O)CS[13CH3] 62a_100012027583_200025704644 [0,2,0,0,0,0|1,0,0]=3 6729 B12R1.16 Cc1ccc(cn1)C(=O)CS[13CH3] 62a_200025704644_100012027583 [0,2,0,0,0,0|1,0,0]=3 6730 B12R1.16 N#CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100011214920 [0,2,0,0,0,0|1,0,0]=3 6731 B12R1.16 N#CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100011214920 [0,2,0,0,0,0|1,0,0]=3 6732 B12R1.16 N#CCC(=O)c1ccc(cc1)F 1458a_100000187176_100011214920 [0,2,0,0,0,0|1,0,0]=3 6733 B12R1.16 N#CCC(=O)c1ccc(cc1)I 1458a_100000187904_100011214920 [0,2,0,0,0,0|1,0,0]=3 6734 B12R1.16 N#CCC(=O)c1ccc(cc1)O 1458a_100000212099_100011214920 [0,2,0,0,0,0|1,0,0]=3 6735 B12R1.16 N#CCC(=O)c1ccc(cc1)O 271570a_203496583355_100000740217 [0,2,0,0,0,0|1,0,0]=3 6736 B12R1.16 O=C(CCF)c1ccc(cc1)Br 1458a_100000185839_100011217306 [0,2,0,0,0,0|1,0,0]=3 6737 B12R1.16 O=C(CCF)c1ccc(cc1)Cl 1458a_100000210187_100011217306 [0,2,0,0,0,0|1,0,0]=3 6738 B12R1.16 O=C(CCF)c1ccc(cc1)F 1458a_100000187176_100011217306 [0,2,0,0,0,0|1,0,0]=3 6739 B12R1.16 O=C(CCF)c1ccc(cc1)I 1458a_100000187904_100011217306 [0,2,0,0,0,0|1,0,0]=3 6740 B12R1.16 O=C(CCF)c1ccc(cc1)O 1458a_100000212099_100011217306 [0,2,0,0,0,0|1,0,0]=3 6741 B12R1.16 O=C(CCO)c1ccc(cc1)Br 1458a_100000185839_100000211926 [0,2,0,0,0,0|1,0,0]=3 6742 B12R1.16 O=C(CCO)c1ccc(cc1)Cl 1458a_100000210187_100000211926 [0,2,0,0,0,0|1,0,0]=3 6743 B12R1.16 O=C(CCO)c1ccc(cc1)F 1458a_100000187176_100000211926 [0,2,0,0,0,0|1,0,0]=3 6744 B12R1.16 O=C(CCO)c1ccc(cc1)I 1458a_100000187904_100000211926 [0,2,0,0,0,0|1,0,0]=3 6745 B12R1.16 O=C(CCO)c1ccc(cc1)O 1458a_100000212099_100000211926 [0,2,0,0,0,0|1,0,0]=3 6746 B12R1.16 [13CH3]OCC(=O)c1ccc(cc1)F 34a_100000246311_200025704644 [0,2,0,0,0,0|1,0,0]=3 6747 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)Br 62a_100000188085_200025704644 [0,2,0,0,0,0|1,0,0]=3 6748 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)Cl 62a_100000211071_200025704644 [0,2,0,0,0,0|1,0,0]=3 6749 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)Cl 62a_200025704644_100000211071 [0,2,0,0,0,0|1,0,0]=3 6750 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)F 62a_100000211279_200025704644 [0,2,0,0,0,0|1,0,0]=3 6751 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)F 62a_200025704644_100000211279 [0,2,0,0,0,0|1,0,0]=3 6752 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)I 62a_100011216261_200025704644 [0,2,0,0,0,0|1,0,0]=3 6753 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)I 62a_200025704644_100011216261 [0,2,0,0,0,0|1,0,0]=3 6754 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)O 62a_100009814261_200025704644 [0,2,0,0,0,0|1,0,0]=3 6755 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)O 62a_200025704644_100009814261 [0,2,0,0,0,0|1,0,0]=3 6756 B12R1.16 [13CH3]SCC(=O)c1ccc(cn1)Cl 62a_100016989621_200025704644 [0,2,0,0,0,0|2,0,0]=4 6757 B12R1.16 [13CH3]SCC(=O)c1ccc(cn1)Cl 62a_200025704644_100016989621 [0,2,0,0,0,0|2,0,0]=4 6758 B12R1.16 [13CH3]SCC(=O)c1ccc(nc1)Cl 62a_100009864725_200025704644 [0,2,0,0,0,0|2,0,0]=4 6759 B12R1.16 [13CH3]SCC(=O)c1ccc(nc1)Cl 62a_200025704644_100009864725 [0,2,0,0,0,0|2,0,0]=4 6760 B12R1.1703 CCC(=O)c1ccc(cc1Br)Br 1458a_100000762965_100000210202 [0,2,0,0,0,0|1,0,0]=3 6761 B12R1.1703 CCC(=O)c1ccc(cc1Br)C 1458a_100000685072_100000210202 [0,2,0,0,0,0|0,0,0]=2 6762 B12R1.1703 CCC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_100000210202 [0,2,0,0,0,0|1,0,0]=3 6763 B12R1.1703 CCC(=O)c1ccc(cc1Br)F 1458a_100000212304_100000210202 [0,2,0,0,0,0|1,0,0]=3 6764 B12R1.1703 CCC(=O)c1ccc(cc1Br)I 1458a_100012360512_100000210202 [0,2,0,0,0,0|1,0,0]=3 6765 B12R1.1703 CCC(=O)c1ccc(cc1Br)O 1458a_100012344906_100000210202 [0,2,0,0,0,0|1,0,0]=3 6766 B12R1.1703 CCC(=O)c1ccc(cc1C)Br 1458a_100000741311_100000210202 [0,2,0,0,0,0|1,0,0]=3 6767 B12R1.1703 CCC(=O)c1ccc(cc1C)C 1458a_100000211164_100000210202 [0,2,0,0,0,0|0,0,0]=2 6768 B12R1.1703 CCC(=O)c1ccc(cc1C)Cl 1458a_100000688705_100000210202 [0,2,0,0,0,0|1,0,0]=3 6769 B12R1.1703 CCC(=O)c1ccc(cc1C)F 1458a_100000686989_100000210202 [0,2,0,0,0,0|1,0,0]=3 6770 B12R1.1703 CCC(=O)c1ccc(cc1C)I 1458a_100010189873_100000210202 [0,2,0,0,0,0|1,0,0]=3 6771 B12R1.1703 CCC(=O)c1ccc(cc1C)O 1458a_100000692822_100000210202 [0,2,0,0,0,0|1,0,0]=3 6772 B12R1.1703 CCC(=O)c1ccc(cc1C)O 271570a_203496583355_200012361375 [0,2,0,0,0,0|1,0,0]=3 6773 B12R1.1703 CCC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_100000210202 [0,2,0,0,0,0|1,0,0]=3 6774 B12R1.1703 CCC(=O)c1ccc(cc1Cl)C 1458a_100000766932_100000210202 [0,2,0,0,0,0|0,0,0]=2 6775 B12R1.1703 CCC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_100000210202 [0,2,0,0,0,0|1,0,0]=3 6776 B12R1.1703 CCC(=O)c1ccc(cc1Cl)F 1458a_100000211397_100000210202 [0,2,0,0,0,0|1,0,0]=3 6777 B12R1.1703 CCC(=O)c1ccc(cc1Cl)I 1458a_100000751301_100000210202 [0,2,0,0,0,0|1,0,0]=3 6778 B12R1.1703 CCC(=O)c1ccc(cc1Cl)O 1458a_100000702456_100000210202 [0,2,0,0,0,0|1,0,0]=3 6779 B12R1.1703 CCC(=O)c1ccc(cc1F)Br 1458a_100000214689_100000210202 [0,2,0,0,0,0|1,0,0]=3 6780 B12R1.1703 CCC(=O)c1ccc(cc1F)C 1458a_100000766033_100000210202 [0,2,0,0,0,0|0,0,0]=2 6781 B12R1.1703 CCC(=O)c1ccc(cc1F)Cl 1458a_100000212326_100000210202 [0,2,0,0,0,0|1,0,0]=3 6782 B12R1.1703 CCC(=O)c1ccc(cc1F)F 1458a_100000211022_100000210202 [0,2,0,0,0,0|1,0,0]=3 6783 B12R1.1703 CCC(=O)c1ccc(cc1F)I 1458a_100000037189_100000210202 [0,2,0,0,0,0|1,0,0]=3 6784 B12R1.1703 CCC(=O)c1ccc(cc1F)O 1458a_100000689029_100000210202 [0,2,0,0,0,0|1,0,0]=3 6785 B12R1.1703 CCC(=O)c1ccc(cc1F)O 271570a_203496583355_100012360378 [0,2,0,0,0,0|1,0,0]=3 6786 B12R1.1703 CCC(=O)c1ccc(cc1I)Br 1458a_100000751167_100000210202 [0,2,0,0,0,0|1,0,0]=3 6787 B12R1.1703 CCC(=O)c1ccc(cc1I)C 1458a_100009999607_100000210202 [0,2,0,0,0,0|0,0,0]=2 6788 B12R1.1703 CCC(=O)c1ccc(cc1I)Cl 1458a_100000739380_100000210202 [0,2,0,0,0,0|1,0,0]=3 6789 B12R1.1703 CCC(=O)c1ccc(cc1I)F 1458a_100000739341_100000210202 [0,2,0,0,0,0|1,0,0]=3 6790 B12R1.1703 CCC(=O)c1ccc(cc1O)Br 1458a_100000744433_100000210202 [0,2,0,0,0,0|1,0,0]=3 6791 B12R1.1703 CCC(=O)c1ccc(cc1O)C 1458a_100000212137_100000210202 [0,2,0,0,0,0|0,0,0]=2 6792 B12R1.1703 CCC(=O)c1ccc(cc1O)C 271570a_203496583355_200012349623 [0,2,0,0,0,0|0,0,0]=2 6793 B12R1.1703 CCC(=O)c1ccc(cc1O)Cl 1458a_100000188622_100000210202 [0,2,0,0,0,0|1,0,0]=3 6794 B12R1.1703 CCC(=O)c1ccc(cc1O)F 1458a_100000746061_100000210202 [0,2,0,0,0,0|1,0,0]=3 6795 B12R1.1703 CCC(=O)c1ccc(cc1O)I 1458a_100000091984_100000210202 [0,2,0,0,0,0|1,0,0]=3 6796 B12R1.1703 CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000210202 [0,2,0,0,0,0|1,0,0]=3 6797 B12R1.1703 CCN(C)c1ccc(cc1Br)C 2230a_100000221369_100000210202 [0,2,0,0,0,0|2,0,0]=4 6798 B12R1.1703 CCN(C)c1ccc(cc1Br)C 269982a_100000221369_100000204670 [0,2,0,0,0,0|2,0,0]=4 6799 B12R1.1703 CCN(C)c1ccc(cc1Br)C 34a_100000221369_100000210202 [0,2,0,0,0,0|2,0,0]=4 6800 B12R1.1703 CNC(=O)c1ccc(cc1Br)Br 11a_106832991635_100000762965 [0,2,0,0,0,0|1,0,0]=3 6801 B12R1.1703 CNC(=O)c1ccc(cc1Br)Br 1626a_100102657272_100000762965 [0,2,0,0,0,0|1,0,0]=3 6802 B12R1.1703 CNC(=O)c1ccc(cc1Br)Br 240690a_100102657272_100000762965 [0,2,0,0,0,0|1,0,0]=3 6803 B12R1.1703 CNC(=O)c1ccc(cc1Br)Br 527a_100102657272_100000762965 [0,2,0,0,0,0|1,0,0]=3 6804 B12R1.1703 CNC(=O)c1ccc(cc1Br)C 11a_106832991635_100000685072 [0,2,0,0,0,0|0,0,0]=2 6805 B12R1.1703 CNC(=O)c1ccc(cc1Br)C 1626a_100102657272_100000685072 [0,2,0,0,0,0|0,0,0]=2 6806 B12R1.1703 CNC(=O)c1ccc(cc1Br)C 240690a_100102657272_100000685072 [0,2,0,0,0,0|0,0,0]=2 6807 B12R1.1703 CNC(=O)c1ccc(cc1Br)C 527a_100102657272_100000685072 [0,2,0,0,0,0|0,0,0]=2 6808 B12R1.1703 CNC(=O)c1ccc(cc1Br)Cl 11a_106832991635_100000766353 [0,2,0,0,0,0|1,0,0]=3 6809 B12R1.1703 CNC(=O)c1ccc(cc1Br)Cl 1626a_100102657272_100000766353 [0,2,0,0,0,0|1,0,0]=3 6810 B12R1.1703 CNC(=O)c1ccc(cc1Br)Cl 240690a_100102657272_100000766353 [0,2,0,0,0,0|1,0,0]=3 6811 B12R1.1703 CNC(=O)c1ccc(cc1Br)Cl 527a_100102657272_100000766353 [0,2,0,0,0,0|1,0,0]=3 6812 B12R1.1703 CNC(=O)c1ccc(cc1Br)F 11a_106832991635_100000212304 [0,2,0,0,0,0|1,0,0]=3 6813 B12R1.1703 CNC(=O)c1ccc(cc1Br)F 1626a_100102657272_100000212304 [0,2,0,0,0,0|1,0,0]=3 6814 B12R1.1703 CNC(=O)c1ccc(cc1Br)F 240690a_100102657272_100000212304 [0,2,0,0,0,0|1,0,0]=3 6815 B12R1.1703 CNC(=O)c1ccc(cc1Br)F 527a_100102657272_100000212304 [0,2,0,0,0,0|1,0,0]=3 6816 B12R1.1703 CNC(=O)c1ccc(cc1Br)I 11a_106832991635_100012360512 [0,2,0,0,0,0|1,0,0]=3 6817 B12R1.1703 CNC(=O)c1ccc(cc1Br)I 1626a_100102657272_100012360512 [0,2,0,0,0,0|1,0,0]=3 6818 B12R1.1703 CNC(=O)c1ccc(cc1Br)I 240690a_100102657272_100012360512 [0,2,0,0,0,0|1,0,0]=3 6819 B12R1.1703 CNC(=O)c1ccc(cc1Br)I 527a_100102657272_100012360512 [0,2,0,0,0,0|1,0,0]=3 6820 B12R1.1703 CNC(=O)c1ccc(cc1Br)O 240690a_100102657272_100012344906 [0,2,0,0,0,0|1,0,0]=3 6821 B12R1.1703 CNC(=O)c1ccc(cc1Br)O 527a_100102657272_100012344906 [0,2,0,0,0,0|1,0,0]=3 6822 B12R1.1703 CNC(=O)c1ccc(cc1C)Br 11a_106832991635_100000741311 [0,2,0,0,0,0|1,0,0]=3 6823 B12R1.1703 CNC(=O)c1ccc(cc1C)Br 1626a_100102657272_100000741311 [0,2,0,0,0,0|1,0,0]=3 6824 B12R1.1703 CNC(=O)c1ccc(cc1C)Br 240690a_100102657272_100000741311 [0,2,0,0,0,0|1,0,0]=3 6825 B12R1.1703 CNC(=O)c1ccc(cc1C)Br 527a_100102657272_100000741311 [0,2,0,0,0,0|1,0,0]=3 6826 B12R1.1703 CNC(=O)c1ccc(cc1C)C 11a_106832991635_100000211164 [0,2,0,0,0,0|0,0,0]=2 6827 B12R1.1703 CNC(=O)c1ccc(cc1C)C 1626a_100102657272_100000211164 [0,2,0,0,0,0|0,0,0]=2 6828 B12R1.1703 CNC(=O)c1ccc(cc1C)C 240690a_100102657272_100000211164 [0,2,0,0,0,0|0,0,0]=2 6829 B12R1.1703 CNC(=O)c1ccc(cc1C)C 527a_100102657272_100000211164 [0,2,0,0,0,0|0,0,0]=2 6830 B12R1.1703 CNC(=O)c1ccc(cc1C)Cl 11a_106832991635_100000688705 [0,2,0,0,0,0|1,0,0]=3 6831 B12R1.1703 CNC(=O)c1ccc(cc1C)Cl 1626a_100102657272_100000688705 [0,2,0,0,0,0|1,0,0]=3 6832 B12R1.1703 CNC(=O)c1ccc(cc1C)Cl 240690a_100102657272_100000688705 [0,2,0,0,0,0|1,0,0]=3 6833 B12R1.1703 CNC(=O)c1ccc(cc1C)Cl 527a_100102657272_100000688705 [0,2,0,0,0,0|1,0,0]=3 6834 B12R1.1703 CNC(=O)c1ccc(cc1C)F 11a_106832991635_100000686989 [0,2,0,0,0,0|1,0,0]=3 6835 B12R1.1703 CNC(=O)c1ccc(cc1C)F 1626a_100102657272_100000686989 [0,2,0,0,0,0|1,0,0]=3 6836 B12R1.1703 CNC(=O)c1ccc(cc1C)F 240690a_100102657272_100000686989 [0,2,0,0,0,0|1,0,0]=3 6837 B12R1.1703 CNC(=O)c1ccc(cc1C)F 527a_100102657272_100000686989 [0,2,0,0,0,0|1,0,0]=3 6838 B12R1.1703 CNC(=O)c1ccc(cc1C)I 11a_106832991635_100010189873 [0,2,0,0,0,0|1,0,0]=3 6839 B12R1.1703 CNC(=O)c1ccc(cc1C)I 1626a_100102657272_100010189873 [0,2,0,0,0,0|1,0,0]=3 6840 B12R1.1703 CNC(=O)c1ccc(cc1C)I 240690a_100102657272_100010189873 [0,2,0,0,0,0|1,0,0]=3 6841 B12R1.1703 CNC(=O)c1ccc(cc1C)I 527a_100102657272_100010189873 [0,2,0,0,0,0|1,0,0]=3 6842 B12R1.1703 CNC(=O)c1ccc(cc1C)O 240690a_100102657272_100000692822 [0,2,0,0,0,0|1,0,0]=3 6843 B12R1.1703 CNC(=O)c1ccc(cc1C)O 527a_100102657272_100000692822 [0,2,0,0,0,0|1,0,0]=3 6844 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Br 11a_106832991635_100000741628 [0,2,0,0,0,0|1,0,0]=3 6845 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Br 1626a_100102657272_100000741628 [0,2,0,0,0,0|1,0,0]=3 6846 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Br 240690a_100102657272_100000741628 [0,2,0,0,0,0|1,0,0]=3 6847 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Br 527a_100102657272_100000741628 [0,2,0,0,0,0|1,0,0]=3 6848 B12R1.1703 CNC(=O)c1ccc(cc1Cl)C 11a_106832991635_100000766932 [0,2,0,0,0,0|0,0,0]=2 6849 B12R1.1703 CNC(=O)c1ccc(cc1Cl)C 1626a_100102657272_100000766932 [0,2,0,0,0,0|0,0,0]=2 6850 B12R1.1703 CNC(=O)c1ccc(cc1Cl)C 240690a_100102657272_100000766932 [0,2,0,0,0,0|0,0,0]=2 6851 B12R1.1703 CNC(=O)c1ccc(cc1Cl)C 527a_100102657272_100000766932 [0,2,0,0,0,0|0,0,0]=2 6852 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Cl 11a_106832991635_100000185840 [0,2,0,0,0,0|1,0,0]=3 6853 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Cl 1626a_100102657272_100000185840 [0,2,0,0,0,0|1,0,0]=3 6854 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Cl 240690a_100102657272_100000185840 [0,2,0,0,0,0|1,0,0]=3 6855 B12R1.1703 CNC(=O)c1ccc(cc1Cl)Cl 527a_100102657272_100000185840 [0,2,0,0,0,0|1,0,0]=3 6856 B12R1.1703 CNC(=O)c1ccc(cc1Cl)F 11a_106832991635_100000211397 [0,2,0,0,0,0|1,0,0]=3 6857 B12R1.1703 CNC(=O)c1ccc(cc1Cl)F 1626a_100102657272_100000211397 [0,2,0,0,0,0|1,0,0]=3 6858 B12R1.1703 CNC(=O)c1ccc(cc1Cl)F 240690a_100102657272_100000211397 [0,2,0,0,0,0|1,0,0]=3 6859 B12R1.1703 CNC(=O)c1ccc(cc1Cl)F 527a_100102657272_100000211397 [0,2,0,0,0,0|1,0,0]=3 6860 B12R1.1703 CNC(=O)c1ccc(cc1Cl)I 11a_106832991635_100000751301 [0,2,0,0,0,0|1,0,0]=3 6861 B12R1.1703 CNC(=O)c1ccc(cc1Cl)I 1626a_100102657272_100000751301 [0,2,0,0,0,0|1,0,0]=3 6862 B12R1.1703 CNC(=O)c1ccc(cc1Cl)I 240690a_100102657272_100000751301 [0,2,0,0,0,0|1,0,0]=3 6863 B12R1.1703 CNC(=O)c1ccc(cc1Cl)I 527a_100102657272_100000751301 [0,2,0,0,0,0|1,0,0]=3 6864 B12R1.1703 CNC(=O)c1ccc(cc1Cl)O 240690a_100102657272_100000702456 [0,2,0,0,0,0|1,0,0]=3 6865 B12R1.1703 CNC(=O)c1ccc(cc1Cl)O 527a_100102657272_100000702456 [0,2,0,0,0,0|1,0,0]=3 6866 B12R1.1703 CNC(=O)c1ccc(cc1F)Br 11a_106832991635_100000214689 [0,2,0,0,0,0|1,0,0]=3 6867 B12R1.1703 CNC(=O)c1ccc(cc1F)Br 1626a_100102657272_100000214689 [0,2,0,0,0,0|1,0,0]=3 6868 B12R1.1703 CNC(=O)c1ccc(cc1F)Br 240690a_100102657272_100000214689 [0,2,0,0,0,0|1,0,0]=3 6869 B12R1.1703 CNC(=O)c1ccc(cc1F)Br 527a_100102657272_100000214689 [0,2,0,0,0,0|1,0,0]=3 6870 B12R1.1703 CNC(=O)c1ccc(cc1F)C 11a_106832991635_100000766033 [0,2,0,0,0,0|0,0,0]=2 6871 B12R1.1703 CNC(=O)c1ccc(cc1F)C 1626a_100102657272_100000766033 [0,2,0,0,0,0|0,0,0]=2 6872 B12R1.1703 CNC(=O)c1ccc(cc1F)C 240690a_100102657272_100000766033 [0,2,0,0,0,0|0,0,0]=2 6873 B12R1.1703 CNC(=O)c1ccc(cc1F)C 527a_100102657272_100000766033 [0,2,0,0,0,0|0,0,0]=2 6874 B12R1.1703 CNC(=O)c1ccc(cc1F)Cl 11a_106832991635_100000212326 [0,2,0,0,0,0|1,0,0]=3 6875 B12R1.1703 CNC(=O)c1ccc(cc1F)Cl 1626a_100102657272_100000212326 [0,2,0,0,0,0|1,0,0]=3 6876 B12R1.1703 CNC(=O)c1ccc(cc1F)Cl 240690a_100102657272_100000212326 [0,2,0,0,0,0|1,0,0]=3 6877 B12R1.1703 CNC(=O)c1ccc(cc1F)Cl 527a_100102657272_100000212326 [0,2,0,0,0,0|1,0,0]=3 6878 B12R1.1703 CNC(=O)c1ccc(cc1F)F 11a_106832991635_100000211022 [0,2,0,0,0,0|1,0,0]=3 6879 B12R1.1703 CNC(=O)c1ccc(cc1F)F 1626a_100102657272_100000211022 [0,2,0,0,0,0|1,0,0]=3 6880 B12R1.1703 CNC(=O)c1ccc(cc1F)F 240690a_100102657272_100000211022 [0,2,0,0,0,0|1,0,0]=3 6881 B12R1.1703 CNC(=O)c1ccc(cc1F)F 527a_100102657272_100000211022 [0,2,0,0,0,0|1,0,0]=3 6882 B12R1.1703 CNC(=O)c1ccc(cc1F)I 11a_106832991635_100000037189 [0,2,0,0,0,0|1,0,0]=3 6883 B12R1.1703 CNC(=O)c1ccc(cc1F)I 1626a_100102657272_100000037189 [0,2,0,0,0,0|1,0,0]=3 6884 B12R1.1703 CNC(=O)c1ccc(cc1F)I 240690a_100102657272_100000037189 [0,2,0,0,0,0|1,0,0]=3 6885 B12R1.1703 CNC(=O)c1ccc(cc1F)I 527a_100102657272_100000037189 [0,2,0,0,0,0|1,0,0]=3 6886 B12R1.1703 CNC(=O)c1ccc(cc1F)O 240690a_100102657272_100000689029 [0,2,0,0,0,0|1,0,0]=3 6887 B12R1.1703 CNC(=O)c1ccc(cc1F)O 271570a_203496583355_100000233932 [0,2,0,0,0,0|1,0,0]=3 6888 B12R1.1703 CNC(=O)c1ccc(cc1F)O 527a_100102657272_100000689029 [0,2,0,0,0,0|1,0,0]=3 6889 B12R1.1703 CNC(=O)c1ccc(cc1I)Br 11a_106832991635_100000751167 [0,2,0,0,0,0|1,0,0]=3 6890 B12R1.1703 CNC(=O)c1ccc(cc1I)Br 1626a_100102657272_100000751167 [0,2,0,0,0,0|1,0,0]=3 6891 B12R1.1703 CNC(=O)c1ccc(cc1I)Br 240690a_100102657272_100000751167 [0,2,0,0,0,0|1,0,0]=3 6892 B12R1.1703 CNC(=O)c1ccc(cc1I)Br 527a_100102657272_100000751167 [0,2,0,0,0,0|1,0,0]=3 6893 B12R1.1703 CNC(=O)c1ccc(cc1I)C 11a_106832991635_100009999607 [0,2,0,0,0,0|0,0,0]=2 6894 B12R1.1703 CNC(=O)c1ccc(cc1I)C 1626a_100102657272_100009999607 [0,2,0,0,0,0|0,0,0]=2 6895 B12R1.1703 CNC(=O)c1ccc(cc1I)C 240690a_100102657272_100009999607 [0,2,0,0,0,0|0,0,0]=2 6896 B12R1.1703 CNC(=O)c1ccc(cc1I)C 527a_100102657272_100009999607 [0,2,0,0,0,0|0,0,0]=2 6897 B12R1.1703 CNC(=O)c1ccc(cc1I)Cl 11a_106832991635_100000739380 [0,2,0,0,0,0|1,0,0]=3 6898 B12R1.1703 CNC(=O)c1ccc(cc1I)Cl 1626a_100102657272_100000739380 [0,2,0,0,0,0|1,0,0]=3 6899 B12R1.1703 CNC(=O)c1ccc(cc1I)Cl 240690a_100102657272_100000739380 [0,2,0,0,0,0|1,0,0]=3 6900 B12R1.1703 CNC(=O)c1ccc(cc1I)Cl 527a_100102657272_100000739380 [0,2,0,0,0,0|1,0,0]=3 6901 B12R1.1703 CNC(=O)c1ccc(cc1I)F 11a_106832991635_100000739341 [0,2,0,0,0,0|1,0,0]=3 6902 B12R1.1703 CNC(=O)c1ccc(cc1I)F 1626a_100102657272_100000739341 [0,2,0,0,0,0|1,0,0]=3 6903 B12R1.1703 CNC(=O)c1ccc(cc1I)F 240690a_100102657272_100000739341 [0,2,0,0,0,0|1,0,0]=3 6904 B12R1.1703 CNC(=O)c1ccc(cc1I)F 527a_100102657272_100000739341 [0,2,0,0,0,0|1,0,0]=3 6905 B12R1.1703 CNC(=O)c1ccc(cc1O)Br 240690a_100102657272_100000744433 [0,2,0,0,0,0|1,0,0]=3 6906 B12R1.1703 CNC(=O)c1ccc(cc1O)Br 527a_100102657272_100000744433 [0,2,0,0,0,0|1,0,0]=3 6907 B12R1.1703 CNC(=O)c1ccc(cc1O)C 1626a_100102657272_100000212137 [0,2,0,0,0,0|0,0,0]=2 6908 B12R1.1703 CNC(=O)c1ccc(cc1O)C 240690a_100102657272_100000212137 [0,2,0,0,0,0|0,0,0]=2 6909 B12R1.1703 CNC(=O)c1ccc(cc1O)C 527a_100102657272_100000212137 [0,2,0,0,0,0|0,0,0]=2 6910 B12R1.1703 CNC(=O)c1ccc(cc1O)Cl 11a_106832991635_100000188622 [0,2,0,0,0,0|1,0,0]=3 6911 B12R1.1703 CNC(=O)c1ccc(cc1O)Cl 240690a_100102657272_100000188622 [0,2,0,0,0,0|1,0,0]=3 6912 B12R1.1703 CNC(=O)c1ccc(cc1O)Cl 527a_100102657272_100000188622 [0,2,0,0,0,0|1,0,0]=3 6913 B12R1.1703 CNC(=O)c1ccc(cc1O)F 240690a_100102657272_100000746061 [0,2,0,0,0,0|1,0,0]=3 6914 B12R1.1703 CNC(=O)c1ccc(cc1O)F 271570a_203496583355_200000206206 [0,2,0,0,0,0|1,0,0]=3 6915 B12R1.1703 CNC(=O)c1ccc(cc1O)F 527a_100102657272_100000746061 [0,2,0,0,0,0|1,0,0]=3 6916 B12R1.1703 CNC(=O)c1ccc(cc1O)I 240690a_100102657272_100000091984 [0,2,0,0,0,0|1,0,0]=3 6917 B12R1.1703 CNC(=O)c1ccc(cc1O)I 527a_100102657272_100000091984 [0,2,0,0,0,0|1,0,0]=3 6918 B12R1.1703 CNC(C)c1ccc(cc1Br)C 269862a_106832991636_100012353930 [0,2,0,0,0,0|1,0,1]=4 6919 B12R1.1703 CNC(C)c1ccc(cc1C)C 269862a_106832991636_100000211561 [0,2,0,0,0,0|1,0,1]=4 6920 B12R1.1703 CNC(C)c1ccc(cc1F)C 269862a_106832991636_100011216410 [0,2,0,0,0,0|1,0,1]=4 6921 B12R1.1703 CNC(C)c1ccc(cc1O)C 269862a_106832991636_100000234885 [0,2,0,0,0,0|1,0,1]=4 6922 B12R1.1703 CN[C@@H](C)c1ccc(cc1C)C 2230a_100000745882_200000210301 [0,2,0,0,0,0|1,0,1]=4 6923 B12R1.1703 CN[C@@H](C)c1ccc(cc1C)C 34a_100000745882_200000210301 [0,2,0,0,0,0|1,0,1]=4 6924 B12R1.1703 COC(=O)c1ccc(c[n+]1[O-])O 271570a_203496583355_100015641791 [0,2,0,0,0,0|2,0,0]=4 6925 B12R1.1703 COC(=O)c1ccc(cc1Br)O 271570a_203496583355_100010247156 [0,2,0,0,0,0|1,0,0]=3 6926 B12R1.1703 COC(=O)c1ccc(cc1C)O 271570a_203496583355_100000747612 [0,2,0,0,0,0|1,0,0]=3 6927 B12R1.1703 COC(=O)c1ccc(cc1Cl)O 271570a_203496583355_100000060724 [0,2,0,0,0,0|1,0,0]=3 6928 B12R1.1703 COC(=O)c1ccc(cc1F)O 271570a_203496583355_100000216654 [0,2,0,0,0,0|1,0,0]=3 6929 B12R1.1703 COC(=O)c1ccc(cc1N)O 271570a_203496583355_100011373473 [0,2,0,0,0,0|1,0,0]=3 6930 B12R1.1703 COC(=O)c1ccc(cc1O)Br 271570a_203496583355_100000701758 [0,2,0,0,0,0|1,0,0]=3 6931 B12R1.1703 COC(=O)c1ccc(cc1O)C 271570a_203496583355_100012340597 [0,2,0,0,0,0|0,0,0]=2 6932 B12R1.1703 COC(=O)c1ccc(cc1O)Cl 271570a_203496583355_100000047510 [0,2,0,0,0,0|1,0,0]=3 6933 B12R1.1703 COC(=O)c1ccc(cc1O)F 271570a_203496583355_100000204356 [0,2,0,0,0,0|1,0,0]=3 6934 B12R1.1703 COC(=O)c1ccc(cc1O)N 271570a_203496583355_100009998378 [0,2,0,0,0,0|1,0,0]=3 6935 B12R1.1703 COC(=O)c1ccc(cc1O)O 271570a_203496583355_100000062286 [0,2,0,0,0,0|1,0,0]=3 6936 B12R1.1703 COC(=O)c1ccc(cc1O)O 271570a_203496583355_100010150825 [0,2,0,0,0,0|1,0,0]=3 6937 B12R1.1703 COC(=O)c1ccc(nc1C)O 271570a_203496583355_100000692007 [0,2,0,0,0,0|2,0,0]=4 6938 B12R1.1703 COC(=O)c1ccc(nc1F)O 271570a_203496583355_100010189635 [0,2,0,0,0,0|2,0,0]=4 6939 B12R1.1703 COC(=O)c1ccc(nc1N)O 271570a_203496583355_100000142702 [0,2,0,0,0,0|2,0,0]=4 6940 B12R1.1703 COC(=O)c1ccc(nc1O)C 271570a_203496583355_100000054099 [0,2,0,0,0,0|1,0,0]=3 6941 B12R1.1703 COC(=O)c1ccc(nc1O)N 271570a_203496583355_100009865240 [0,2,0,0,0,0|2,0,0]=4 6942 B12R1.1703 COC(=O)c1ccc(nc1O)O 271570a_203496583355_100015962272 [0,2,0,0,0,0|2,0,0]=4 6943 B12R1.1703 COC(=O)c1ccc(nc1O)O 271570a_203496583355_100016008356 [0,2,0,0,0,0|2,0,0]=4 6944 B12R1.1703 COC(=O)c1cnc(cc1C)O 271570a_203496583355_100009871181 [0,2,0,0,0,0|2,0,0]=4 6945 B12R1.1703 COC(=O)c1cnc(cc1N)O 271570a_203496583355_100009862510 [0,2,0,0,0,0|2,0,0]=4 6946 B12R1.1703 COC(=O)c1cnc(cc1O)C 271570a_203496583355_100011998247 [0,2,0,0,0,0|1,0,0]=3 6947 B12R1.1703 COC(=O)c1ncc(cc1C)O 271570a_203496583355_100010178714 [0,2,0,0,0,0|2,0,0]=4 6948 B12R1.1703 COC(=O)c1ncc(cc1F)O 271570a_203496583355_100000695675 [0,2,0,0,0,0|2,0,0]=4 6949 B12R1.1703 COC(=O)c1ncc(cc1N)O 271570a_203496583355_100010090751 [0,2,0,0,0,0|2,0,0]=4 6950 B12R1.1703 COC(=O)c1ncc(cc1O)C 271570a_203496583355_100010167497 [0,2,0,0,0,0|1,0,0]=3 6951 B12R1.1703 COC(=O)c1ncc(cc1O)F 271570a_203496583355_100010189631 [0,2,0,0,0,0|2,0,0]=4 6952 B12R1.1703 COC(=O)c1ncc(cc1O)O 271570a_203496583355_100010071521 [0,2,0,0,0,0|2,0,0]=4 6953 B12R1.1703 COC(=O)c1ncc(nc1O)C 271570a_203496583355_100000099855 [0,2,0,0,0,0|2,0,0]=4 6954 B12R1.1703 COC(C)c1ccc(cc1C)C 34a_100000246504_200000210301 [0,2,0,0,0,0|0,0,2]=4 6955 B12R1.1703 COC(C)c1ccc(cc1C)C 7a_100000246504_200000210301 [0,2,0,0,0,0|0,0,2]=4 6956 B12R1.1703 Cc1cc(ccc1C(=O)CF)Br 1458a_100000741311_100015361967 [0,2,0,0,0,0|1,0,0]=3 6957 B12R1.1703 Cc1cc(ccc1C(=O)CF)Cl 1458a_100000688705_100015361967 [0,2,0,0,0,0|1,0,0]=3 6958 B12R1.1703 Cc1cc(ccc1C(=O)CF)F 1458a_100000686989_100015361967 [0,2,0,0,0,0|1,0,0]=3 6959 B12R1.1703 Cc1cc(ccc1C(=O)CF)I 1458a_100010189873_100015361967 [0,2,0,0,0,0|1,0,0]=3 6960 B12R1.1703 Cc1cc(ccc1C(=O)CF)O 1458a_100000692822_100015361967 [0,2,0,0,0,0|1,0,0]=3 6961 B12R1.1703 Cc1ccc(c(c1)Br)C(=O)CF 1458a_100000685072_100015361967 [0,2,0,0,0,0|0,0,0]=2 6962 B12R1.1703 Cc1ccc(c(c1)Br)N(C)CF 269982a_100000221369_100015361967 [0,2,0,0,0,0|2,0,0]=4 6963 B12R1.1703 Cc1ccc(c(c1)Br)N(C)CF 34a_100000221369_100015361967 [0,2,0,0,0,0|2,0,0]=4 6964 B12R1.1703 Cc1ccc(c(c1)C)C(=O)CF 1458a_100000211164_100015361967 [0,2,0,0,0,0|0,0,0]=2 6965 B12R1.1703 Cc1ccc(c(c1)C)C(C)O[13CH3] 34a_100000246504_200025704644 [0,2,0,0,0,0|0,0,2]=4 6966 B12R1.1703 Cc1ccc(c(c1)C)C(C)O[13CH3] 7a_100000246504_200025704644 [0,2,0,0,0,0|0,0,2]=4 6967 B12R1.1703 Cc1ccc(c(c1)C)[C@H](C)N[13CH3] 2230a_100000745882_200025704644 [0,2,0,0,0,0|1,0,1]=4 6968 B12R1.1703 Cc1ccc(c(c1)C)[C@H](C)N[13CH3] 34a_100000745882_200025704644 [0,2,0,0,0,0|1,0,1]=4 6969 B12R1.1703 Cc1ccc(c(c1)Cl)C(=O)CF 1458a_100000766932_100015361967 [0,2,0,0,0,0|0,0,0]=2 6970 B12R1.1703 Cc1ccc(c(c1)F)C(=O)CF 1458a_100000766033_100015361967 [0,2,0,0,0,0|0,0,0]=2 6971 B12R1.1703 Cc1ccc(c(c1)I)C(=O)CF 1458a_100009999607_100015361967 [0,2,0,0,0,0|0,0,0]=2 6972 B12R1.1703 Cc1ccc(c(c1)O)C(=O)CF 1458a_100000212137_100015361967 [0,2,0,0,0,0|0,0,0]=2 6973 B12R1.1703 Cc1ccc(c(c1)O)C(=O)NN 271570a_203496583355_200012340525 [0,2,0,0,0,0|1,0,0]=3 6974 B12R1.1703 NNC(=O)c1ccc(cc1O)F 271570a_203496583355_100000203923 [0,2,0,0,0,0|2,0,0]=4 6975 B12R1.1703 O=C(CF)c1ccc(cc1Br)Br 1458a_100000762965_100015361967 [0,2,0,0,0,0|1,0,0]=3 6976 B12R1.1703 O=C(CF)c1ccc(cc1Br)Cl 1458a_100000766353_100015361967 [0,2,0,0,0,0|1,0,0]=3 6977 B12R1.1703 O=C(CF)c1ccc(cc1Br)F 1458a_100000212304_100015361967 [0,2,0,0,0,0|1,0,0]=3 6978 B12R1.1703 O=C(CF)c1ccc(cc1Br)I 1458a_100012360512_100015361967 [0,2,0,0,0,0|1,0,0]=3 6979 B12R1.1703 O=C(CF)c1ccc(cc1Br)O 1458a_100012344906_100015361967 [0,2,0,0,0,0|1,0,0]=3 6980 B12R1.1703 O=C(CF)c1ccc(cc1Cl)Br 1458a_100000741628_100015361967 [0,2,0,0,0,0|1,0,0]=3 6981 B12R1.1703 O=C(CF)c1ccc(cc1Cl)Cl 1458a_100000185840_100015361967 [0,2,0,0,0,0|1,0,0]=3 6982 B12R1.1703 O=C(CF)c1ccc(cc1Cl)F 1458a_100000211397_100015361967 [0,2,0,0,0,0|1,0,0]=3 6983 B12R1.1703 O=C(CF)c1ccc(cc1Cl)I 1458a_100000751301_100015361967 [0,2,0,0,0,0|1,0,0]=3 6984 B12R1.1703 O=C(CF)c1ccc(cc1Cl)O 1458a_100000702456_100015361967 [0,2,0,0,0,0|1,0,0]=3 6985 B12R1.1703 O=C(CF)c1ccc(cc1F)Br 1458a_100000214689_100015361967 [0,2,0,0,0,0|1,0,0]=3 6986 B12R1.1703 O=C(CF)c1ccc(cc1F)Cl 1458a_100000212326_100015361967 [0,2,0,0,0,0|1,0,0]=3 6987 B12R1.1703 O=C(CF)c1ccc(cc1F)F 1458a_100000211022_100015361967 [0,2,0,0,0,0|1,0,0]=3 6988 B12R1.1703 O=C(CF)c1ccc(cc1F)I 1458a_100000037189_100015361967 [0,2,0,0,0,0|1,0,0]=3 6989 B12R1.1703 O=C(CF)c1ccc(cc1F)O 1458a_100000689029_100015361967 [0,2,0,0,0,0|1,0,0]=3 6990 B12R1.1703 O=C(CF)c1ccc(cc1I)Br 1458a_100000751167_100015361967 [0,2,0,0,0,0|1,0,0]=3 6991 B12R1.1703 O=C(CF)c1ccc(cc1I)Cl 1458a_100000739380_100015361967 [0,2,0,0,0,0|1,0,0]=3 6992 B12R1.1703 O=C(CF)c1ccc(cc1I)F 1458a_100000739341_100015361967 [0,2,0,0,0,0|1,0,0]=3 6993 B12R1.1703 O=C(CF)c1ccc(cc1O)Br 1458a_100000744433_100015361967 [0,2,0,0,0,0|1,0,0]=3 6994 B12R1.1703 O=C(CF)c1ccc(cc1O)Cl 1458a_100000188622_100015361967 [0,2,0,0,0,0|1,0,0]=3 6995 B12R1.1703 O=C(CF)c1ccc(cc1O)F 1458a_100000746061_100015361967 [0,2,0,0,0,0|1,0,0]=3 6996 B12R1.1703 O=C(CF)c1ccc(cc1O)I 1458a_100000091984_100015361967 [0,2,0,0,0,0|1,0,0]=3 6997 B12R1.1703 O=C(CF)c1ccc(cc1O)O 1458a_100000212172_100015361967 [0,2,0,0,0,0|1,0,0]=3 6998 B12R1.57 C=C(C)c1ccc(cc1C#N)Br 271570a_100000694244_100011219714 [0,2,0,0,0,0|2,0,0]=4 6999 B12R1.57 C=C(C)c1ccc(cc1C#N)C 271570a_100000694244_100011935190 [0,2,0,0,0,0|1,0,0]=3 7000 B12R1.57 C=C(C)c1ccc(cc1C#N)Cl 271570a_100000694244_200011356825 [0,2,0,0,0,0|2,0,0]=4 7001 B12R1.57 C=C(C)c1ccc(cc1C#N)F 271570a_100000694244_100000747550 [0,2,0,0,0,0|2,0,0]=4 7002 B12R1.57 C=C(C)c1ccc(cc1C#N)N 271570a_100000694244_100011934039 [0,2,0,0,0,0|2,0,0]=4 7003 B12R1.57 C=C(C)c1ccc(cc1C#N)O 271570a_100000694244_100009818209 [0,2,0,0,0,0|2,0,0]=4 7004 B12R1.57 C=C(C)c1ccc(cc1C=O)Br 271570a_100000694244_100010185651 [0,2,0,0,0,0|2,0,0]=4 7005 B12R1.57 C=C(C)c1ccc(cc1C=O)C 271570a_100000694244_100011551863 [0,2,0,0,0,0|1,0,0]=3 7006 B12R1.57 C=C(C)c1ccc(cc1C=O)Cl 271570a_100000694244_100010254386 [0,2,0,0,0,0|2,0,0]=4 7007 B12R1.57 C=C(C)c1ccc(cc1C=O)F 271570a_100000694244_100011218309 [0,2,0,0,0,0|2,0,0]=4 7008 B12R1.57 C=C(C)c1ccc(cc1C=O)O 271570a_100000694244_100000690577 [0,2,0,0,0,0|2,0,0]=4 7009 B12R1.57 C=C(C)c1ccc(cc1CC)Br 271570a_100000694244_100011216195 [0,2,0,0,0,0|2,0,0]=4 7010 B12R1.57 C=C(C)c1ccc(cc1CC)N 271570a_100000694244_100010109747 [0,2,0,0,0,0|2,0,0]=4 7011 B12R1.57 C=C(C)c1ccc(cc1CN)F 271570a_100000694244_100000742738 [0,2,0,0,0,0|2,0,0]=4 7012 B12R1.57 C=C(C)c1ccc(cc1CO)Br 271570a_100000694244_100011356890 [0,2,0,0,0,0|2,0,0]=4 7013 B12R1.57 C=C(C)c1ccc(cc1CO)C 271570a_100000694244_100012361352 [0,2,0,0,0,0|1,0,0]=3 7014 B12R1.57 C=C(C)c1ccc(cc1CO)F 271570a_100000694244_100011217561 [0,2,0,0,0,0|2,0,0]=4 7015 B12R1.57 C=C(C)c1ccc(cc1CO)N 271570a_100000694244_100012347228 [0,2,0,0,0,0|2,0,0]=4 7016 B12R1.57 C=C(C)c1ccc(cc1CO)O 271570a_100000694244_100012351483 [0,2,0,0,0,0|2,0,0]=4 7017 B12R1.57 C=C(C)c1ccc(cc1NC)F 271570a_100000694244_100020633008 [0,2,0,0,0,0|2,0,0]=4 7018 B12R1.57 C=C(C)c1ccc(cc1NN)F 271570a_100000694244_100012362518 [0,2,0,0,0,0|2,0,0]=4 7019 B12R1.57 C=C(C)c1ccc(cc1OC)Br 271570a_100000694244_100010245111 [0,2,0,0,0,0|2,0,0]=4 7020 B12R1.57 C=C(C)c1ccc(cc1OC)C 271570a_100000694244_100010200004 [0,2,0,0,0,0|1,0,0]=3 7021 B12R1.57 C=C(C)c1ccc(cc1OC)Cl 271570a_100000694244_100000050115 [0,2,0,0,0,0|2,0,0]=4 7022 B12R1.57 C=C(C)c1ccc(cc1OC)F 271570a_100000694244_100000757151 [0,2,0,0,0,0|2,0,0]=4 7023 B12R1.57 C=C(C)c1ccc(cc1OC)N 271570a_100000694244_100000765947 [0,2,0,0,0,0|2,0,0]=4 7024 B12R1.57 C=C(C)c1ccc(cc1OC)O 271570a_100000694244_100011827694 [0,2,0,0,0,0|2,0,0]=4 7025 B12R1.57 C=C(C)c1ccc(cc1SC)C 271570a_100000694244_200010709736 [0,2,0,0,0,0|1,0,0]=3 7026 B12R1.57 C=C(C)c1ccc(nc1C#N)C 271570a_100000694244_100009878477 [0,2,0,0,0,0|2,0,0]=4 7027 B12R1.57 C=C(C)c1ccc(nc1C=O)C 271570a_100000694244_100010173661 [0,2,0,0,0,0|2,0,0]=4 7028 B12R1.57 C=C(C)c1ccc(nc1CO)C 271570a_100000694244_100010074375 [0,2,0,0,0,0|2,0,0]=4 7029 B12R1.57 C=C(C)c1ccc(nc1OC)C 271570a_100000694244_100010138632 [0,2,0,0,0,0|2,0,0]=4 7030 B12R1.57 C=C(C)c1cnc(cc1CO)C 271570a_100000694244_100015579599 [0,2,0,0,0,0|2,0,0]=4 7031 B12R1.57 C=C(C)c1cnc(cc1OC)C 271570a_100000694244_100000717771 [0,2,0,0,0,0|2,0,0]=4 7032 B12R1.57 C=C(C)c1ncc(cc1C#N)C 271570a_100000694244_100012662280 [0,2,0,0,0,0|2,0,0]=4 7033 B12R1.57 C=C(C)c1ncc(cc1C=O)C 271570a_100000694244_100000050350 [0,2,0,0,0,0|2,0,0]=4 7034 B12R1.57 C=C(C)c1ncc(cc1CO)C 271570a_100000694244_100000118064 [0,2,0,0,0,0|2,0,0]=4 7035 B12R1.57 C=C(C)c1ncc(cc1OC)C 271570a_100000694244_200000118316 [0,2,0,0,0,0|2,0,0]=4 7036 B12R1.57 C=C(C)c1ncc(cc1SC)C 271570a_100000694244_100010884634 [0,2,0,0,0,0|2,0,0]=4 7037 B12R1.57 C=Cc1cc(ccc1C(=O)C)C 271570a_100011290941_100012353930 [0,2,0,0,0,0|0,0,0]=2 7038 B12R1.57 C=Cc1cc(ccc1C(=O)C)F 271570a_100011290941_100000686192 [0,2,0,0,0,0|1,0,0]=3 7039 B12R1.57 C=Cc1cc(ccc1C(=O)C)O 271570a_100011290941_100012340537 [0,2,0,0,0,0|1,0,0]=3 7040 B12R1.57 C=Cc1cc(ccc1C(=O)N)Br 271570a_100011290941_100009815748 [0,2,0,0,0,0|2,0,0]=4 7041 B12R1.57 C=Cc1cc(ccc1C(=O)N)F 271570a_100011290941_100000206404 [0,2,0,0,0,0|2,0,0]=4 7042 B12R1.57 C=Cc1cc(ccc1N(C)C)C 271570a_100011290941_100012353700 [0,2,0,0,0,0|2,0,0]=4 7043 B12R1.57 C=Cc1nc(ccc1C(=O)N)C 271570a_100011290941_100000041523 [0,2,0,0,0,0|2,0,0]=4 7044 B12R1.57 CC(=O)c1ccc(cc1C#N)Br 1458a_100012349539_200000210301 [0,2,0,0,0,0|1,0,0]=3 7045 B12R1.57 CC(=O)c1ccc(cc1C#N)C 1458a_200012184421_200000210301 [0,2,0,0,0,0|0,0,0]=2 7046 B12R1.57 CC(=O)c1ccc(cc1C#N)F 1458a_100012002388_200000210301 [0,2,0,0,0,0|1,0,0]=3 7047 B12R1.57 CC(=O)c1ccc(cc1CO)Br 1458a_100010253900_200000210301 [0,2,0,0,0,0|1,0,0]=3 7048 B12R1.57 CC(=O)c1ccc(cc1CO)F 1458a_100013035055_200000210301 [0,2,0,0,0,0|1,0,0]=3 7049 B12R1.57 CC(=O)c1ccc(cc1O[13CH3])Br 7a_100000188348_200025704644 [0,2,0,0,0,0|1,0,0]=3 7050 B12R1.57 CC(=O)c1ccc(cc1O[13CH3])C 34a_100000234885_200025704644 [0,2,0,0,0,0|0,0,0]=2 7051 B12R1.57 CC(=O)c1ccc(cc1O[13CH3])C 7a_100000234885_200025704644 [0,2,0,0,0,0|0,0,0]=2 7052 B12R1.57 CC(=O)c1ccc(cc1O[13CH3])Cl 34a_100000061402_200025704644 [0,2,0,0,0,0|1,0,0]=3 7053 B12R1.57 CC(=O)c1ccc(cc1O[13CH3])Cl 7a_100000061402_200025704644 [0,2,0,0,0,0|1,0,0]=3 7054 B12R1.57 CC(=O)c1ccc(cc1O[13CH3])F 7a_100011215782_200025704644 [0,2,0,0,0,0|1,0,0]=3 7055 B12R1.57 CC(=O)c1ccc(cc1S[13CH3])C 62a_100012353930_200025704644 [0,2,0,0,0,0|0,0,0]=2 7056 B12R1.57 CC(=O)c1ccc(cc1S[13CH3])C 62a_200025704644_100012353930 [0,2,0,0,0,0|0,0,0]=2 7057 B12R1.57 CC(=O)c1ccc(cc1S[13CH3])F 62a_100000686192_200025704644 [0,2,0,0,0,0|1,0,0]=3 7058 B12R1.57 CC(=O)c1ccc(cc1S[13CH3])O 62a_100012340537_200025704644 [0,2,0,0,0,0|1,0,0]=3 7059 B12R1.57 CCc1cc(ccc1C(=O)C)Br 1458a_200012349896_200000210301 [0,2,0,0,0,0|1,0,0]=3 7060 B12R1.57 CCc1cc(ccc1C(=O)[13CH3])Br 1458a_200012349896_200025704644 [0,2,0,0,0,0|1,0,0]=3 7061 B12R1.57 CNc1cc(ccc1C(=O)C)F 27a_100102657272_100000686192 [0,2,0,0,0,0|1,0,0]=3 7062 B12R1.57 CNc1cc(ccc1C(=O)N)Br 27a_100102657272_100009815748 [0,2,0,0,0,0|2,0,0]=4 7063 B12R1.57 CNc1cc(ccc1C(=O)N)Br 7a_100012349972_200000210301 [0,2,0,0,0,0|2,0,0]=4 7064 B12R1.57 CNc1cc(ccc1C(=O)N)C 34a_100011219537_200000210301 [0,2,0,0,0,0|1,0,0]=3 7065 B12R1.57 CNc1cc(ccc1C(=O)N)C 7a_100011219537_200000210301 [0,2,0,0,0,0|1,0,0]=3 7066 B12R1.57 CNc1cc(ccc1C(=O)N)Cl 34a_100000738103_200000210301 [0,2,0,0,0,0|2,0,0]=4 7067 B12R1.57 CNc1cc(ccc1C(=O)N)Cl 7a_100000738103_200000210301 [0,2,0,0,0,0|2,0,0]=4 7068 B12R1.57 CNc1cc(ccc1C(=O)N)F 27a_100102657272_100000206404 [0,2,0,0,0,0|2,0,0]=4 7069 B12R1.57 CNc1cc(ccc1C(=O)N)F 34a_100011298637_200000210301 [0,2,0,0,0,0|2,0,0]=4 7070 B12R1.57 CNc1nc(ccc1C(=O)N)C 27a_100102657272_100000041523 [0,2,0,0,0,0|2,0,0]=4 7071 B12R1.57 COc1cc(ccc1C(=O)C)Br 1458a_100000748230_200000210301 [0,2,0,0,0,0|1,0,0]=3 7072 B12R1.57 COc1cc(ccc1C(=O)C)Br 7a_100000188348_200000210301 [0,2,0,0,0,0|1,0,0]=3 7073 B12R1.57 COc1cc(ccc1C(=O)C)C 1458a_100000217210_200000210301 [0,2,0,0,0,0|0,0,0]=2 7074 B12R1.57 COc1cc(ccc1C(=O)C)C 34a_100000234885_200000210301 [0,2,0,0,0,0|0,0,0]=2 7075 B12R1.57 COc1cc(ccc1C(=O)C)C 7a_100000234885_200000210301 [0,2,0,0,0,0|0,0,0]=2 7076 B12R1.57 COc1cc(ccc1C(=O)C)Cl 1458a_100000217211_200000210301 [0,2,0,0,0,0|1,0,0]=3 7077 B12R1.57 COc1cc(ccc1C(=O)C)Cl 34a_100000061402_200000210301 [0,2,0,0,0,0|1,0,0]=3 7078 B12R1.57 COc1cc(ccc1C(=O)C)Cl 7a_100000061402_200000210301 [0,2,0,0,0,0|1,0,0]=3 7079 B12R1.57 COc1cc(ccc1C(=O)C)F 1458a_100000239970_200000210301 [0,2,0,0,0,0|1,0,0]=3 7080 B12R1.57 COc1cc(ccc1C(=O)C)F 7a_100011215782_200000210301 [0,2,0,0,0,0|1,0,0]=3 7081 B12R1.57 COc1cc(ccc1C(=O)C)I 1458a_100012353712_200000210301 [0,2,0,0,0,0|1,0,0]=3 7082 B12R1.57 COc1cc(ccc1C(=O)C)O 271570a_203496583355_100000709911 [0,2,0,0,0,0|1,0,0]=3 7083 B12R1.57 COc1cc(ccc1C(=O)N)Br 34a_100011550861_200000210301 [0,2,0,0,0,0|2,0,0]=4 7084 B12R1.57 COc1cc(ccc1C(=O)N)Br 7a_100011550861_200000210301 [0,2,0,0,0,0|2,0,0]=4 7085 B12R1.57 COc1cc(ccc1C(=O)N)C 34a_100000192831_200000210301 [0,2,0,0,0,0|1,0,0]=3 7086 B12R1.57 COc1cc(ccc1C(=O)N)C 7a_100000192831_200000210301 [0,2,0,0,0,0|1,0,0]=3 7087 B12R1.57 COc1cc(ccc1C(=O)N)Cl 34a_100000192836_200000210301 [0,2,0,0,0,0|2,0,0]=4 7088 B12R1.57 COc1cc(ccc1C(=O)N)Cl 7a_100000192836_200000210301 [0,2,0,0,0,0|2,0,0]=4 7089 B12R1.57 COc1cc(ccc1C(=O)N)N 34a_100000223280_200000210301 [0,2,0,0,0,0|2,0,0]=4 7090 B12R1.57 COc1cc(ccc1C(=O)N)N 7a_100000223280_200000210301 [0,2,0,0,0,0|2,0,0]=4 7091 B12R1.57 COc1cc(ccc1C(=O)N)O 271570a_203496583355_100000748320 [0,2,0,0,0,0|2,0,0]=4 7092 B12R1.57 COc1cc(ccc1C(=O)[13CH3])Br 1458a_100000748230_200025704644 [0,2,0,0,0,0|1,0,0]=3 7093 B12R1.57 COc1cc(ccc1C(=O)[13CH3])C 1458a_100000217210_200025704644 [0,2,0,0,0,0|0,0,0]=2 7094 B12R1.57 COc1cc(ccc1C(=O)[13CH3])Cl 1458a_100000217211_200025704644 [0,2,0,0,0,0|1,0,0]=3 7095 B12R1.57 COc1cc(ccc1C(=O)[13CH3])F 1458a_100000239970_200025704644 [0,2,0,0,0,0|1,0,0]=3 7096 B12R1.57 COc1cc(ccc1C(=O)[13CH3])I 1458a_100012353712_200025704644 [0,2,0,0,0,0|1,0,0]=3 7097 B12R1.57 COc1cc(ccc1C(C)C)C 34a_100000185798_200000210301 [0,2,0,0,0,0|1,0,1]=4 7098 B12R1.57 COc1cc(ccc1C(C)C)C 7a_100000185798_200000210301 [0,2,0,0,0,0|1,0,1]=4 7099 B12R1.57 COc1cc(ccc1[N+](=O)[O-])C 34a_100000195450_200000210301 [0,2,0,0,0,0|2,0,0]=4 7100 B12R1.57 COc1cc(ccc1[N+](=O)[O-])C 7a_100000195450_200000210301 [0,2,0,0,0,0|2,0,0]=4 7101 B12R1.57 COc1cc(cnc1C(=O)C)O 271570a_203496583355_100010137934 [0,2,0,0,0,0|2,0,0]=4 7102 B12R1.57 CSc1cc(ccc1C(=O)C)C 62a_100012353930_200000210301 [0,2,0,0,0,0|0,0,0]=2 7103 B12R1.57 CSc1cc(ccc1C(=O)C)C 62a_200000210301_100012353930 [0,2,0,0,0,0|0,0,0]=2 7104 B12R1.57 CSc1cc(ccc1C(=O)C)F 62a_100000686192_200000210301 [0,2,0,0,0,0|1,0,0]=3 7105 B12R1.57 CSc1cc(ccc1C(=O)C)O 62a_100012340537_200000210301 [0,2,0,0,0,0|1,0,0]=3 7106 B12R1.57 CSc1cc(ccc1C(=O)N)Br 62a_100009815748_200000210301 [0,2,0,0,0,0|2,0,0]=4 7107 B12R1.57 CSc1cc(ccc1C(=O)N)F 62a_100000206404_200000210301 [0,2,0,0,0,0|2,0,0]=4 7108 B12R1.57 CSc1cc(ccc1C(=O)N)F 62a_200000210301_100000206404 [0,2,0,0,0,0|2,0,0]=4 7109 B12R1.57 CSc1cc(ccc1N(C)C)C 62a_100012353700_200000210301 [0,2,0,0,0,0|2,0,0]=4 7110 B12R1.57 CSc1cc(ccc1N(C)C)C 62a_200000210301_100012353700 [0,2,0,0,0,0|2,0,0]=4 7111 B12R1.57 CSc1nc(ccc1C(=O)N)C 62a_100000041523_200000210301 [0,2,0,0,0,0|2,0,0]=4 7112 B12R1.57 CSc1nc(ccc1C(=O)N)C 62a_200000210301_100000041523 [0,2,0,0,0,0|2,0,0]=4 7113 B12R1.57 Cc1ccc(c(c1)C#N)C(=O)[13CH3] 1458a_200012184421_200025704644 [0,2,0,0,0,0|0,0,0]=2 7114 B12R1.57 Cc1ccc(c(c1)N[13CH3])C(=O)N 34a_100011219537_200025704644 [0,2,0,0,0,0|1,0,0]=3 7115 B12R1.57 Cc1ccc(c(c1)N[13CH3])C(=O)N 7a_100011219537_200025704644 [0,2,0,0,0,0|1,0,0]=3 7116 B12R1.57 Cc1ccc(c(c1)O[13CH3])C(=O)N 34a_100000192831_200025704644 [0,2,0,0,0,0|1,0,0]=3 7117 B12R1.57 Cc1ccc(c(c1)O[13CH3])C(=O)N 7a_100000192831_200025704644 [0,2,0,0,0,0|1,0,0]=3 7118 B12R1.57 Cc1ccc(c(c1)O[13CH3])C(C)C 34a_100000185798_200025704644 [0,2,0,0,0,0|1,0,1]=4 7119 B12R1.57 Cc1ccc(c(c1)O[13CH3])C(C)C 7a_100000185798_200025704644 [0,2,0,0,0,0|1,0,1]=4 7120 B12R1.57 Cc1ccc(c(c1)O[13CH3])[N+](=O)[O-] 34a_100000195450_200025704644 [0,2,0,0,0,0|2,0,0]=4 7121 B12R1.57 Cc1ccc(c(c1)O[13CH3])[N+](=O)[O-] 7a_100000195450_200025704644 [0,2,0,0,0,0|2,0,0]=4 7122 B12R1.57 Cc1ccc(c(c1)S[13CH3])N(C)C 62a_100012353700_200025704644 [0,2,0,0,0,0|2,0,0]=4 7123 B12R1.57 Cc1ccc(c(c1)S[13CH3])N(C)C 62a_200025704644_100012353700 [0,2,0,0,0,0|2,0,0]=4 7124 B12R1.57 Cc1ccc(c(n1)S[13CH3])C(=O)N 62a_100000041523_200025704644 [0,2,0,0,0,0|2,0,0]=4 7125 B12R1.57 Cc1ccc(c(n1)S[13CH3])C(=O)N 62a_200025704644_100000041523 [0,2,0,0,0,0|2,0,0]=4 7126 B12R1.57 [13CH3]C(=O)c1ccc(cc1C#N)Br 1458a_100012349539_200025704644 [0,2,0,0,0,0|1,0,0]=3 7127 B12R1.57 [13CH3]C(=O)c1ccc(cc1C#N)F 1458a_100012002388_200025704644 [0,2,0,0,0,0|1,0,0]=3 7128 B12R1.57 [13CH3]C(=O)c1ccc(cc1CO)Br 1458a_100010253900_200025704644 [0,2,0,0,0,0|1,0,0]=3 7129 B12R1.57 [13CH3]C(=O)c1ccc(cc1CO)F 1458a_100013035055_200025704644 [0,2,0,0,0,0|1,0,0]=3 7130 B12R1.57 [13CH3]Nc1cc(ccc1C(=O)N)Br 7a_100012349972_200025704644 [0,2,0,0,0,0|2,0,0]=4 7131 B12R1.57 [13CH3]Nc1cc(ccc1C(=O)N)Cl 34a_100000738103_200025704644 [0,2,0,0,0,0|2,0,0]=4 7132 B12R1.57 [13CH3]Nc1cc(ccc1C(=O)N)Cl 7a_100000738103_200025704644 [0,2,0,0,0,0|2,0,0]=4 7133 B12R1.57 [13CH3]Nc1cc(ccc1C(=O)N)F 34a_100011298637_200025704644 [0,2,0,0,0,0|2,0,0]=4 7134 B12R1.57 [13CH3]Oc1cc(ccc1C(=O)N)Br 34a_100011550861_200025704644 [0,2,0,0,0,0|2,0,0]=4 7135 B12R1.57 [13CH3]Oc1cc(ccc1C(=O)N)Br 7a_100011550861_200025704644 [0,2,0,0,0,0|2,0,0]=4 7136 B12R1.57 [13CH3]Oc1cc(ccc1C(=O)N)Cl 34a_100000192836_200025704644 [0,2,0,0,0,0|2,0,0]=4 7137 B12R1.57 [13CH3]Oc1cc(ccc1C(=O)N)Cl 7a_100000192836_200025704644 [0,2,0,0,0,0|2,0,0]=4 7138 B12R1.57 [13CH3]Oc1cc(ccc1C(=O)N)N 34a_100000223280_200025704644 [0,2,0,0,0,0|2,0,0]=4 7139 B12R1.57 [13CH3]Oc1cc(ccc1C(=O)N)N 7a_100000223280_200025704644 [0,2,0,0,0,0|2,0,0]=4 7140 B12R1.57 [13CH3]Sc1cc(ccc1C(=O)N)Br 62a_100009815748_200025704644 [0,2,0,0,0,0|2,0,0]=4 7141 B12R1.57 [13CH3]Sc1cc(ccc1C(=O)N)F 62a_100000206404_200025704644 [0,2,0,0,0,0|2,0,0]=4 7142 B12R1.57 [13CH3]Sc1cc(ccc1C(=O)N)F 62a_200025704644_100000206404 [0,2,0,0,0,0|2,0,0]=4 7143 B12R1.1000 C=C(C)c1c(cc(cc1Br)Br)F 271570a_100000694244_100000708766 [0,2,0,0,0,0|2,0,0]=4 7144 B12R1.1000 C=C(C)c1c(cc(cc1Br)C)Br 271570a_100000694244_200011219743 [0,2,0,0,0,0|1,0,0]=3 7145 B12R1.1000 C=C(C)c1c(cc(cc1Br)C)C 271570a_100000694244_200012353697 [0,2,0,0,0,0|1,0,0]=3 7146 B12R1.1000 C=C(C)c1c(cc(cc1Br)C)F 271570a_100000694244_100010208195 [0,2,0,0,0,0|1,0,0]=3 7147 B12R1.1000 C=C(C)c1c(cc(cc1Br)Cl)Cl 271570a_100000694244_200009992027 [0,2,0,0,0,0|2,0,0]=4 7148 B12R1.1000 C=C(C)c1c(cc(cc1Br)Cl)F 271570a_100000694244_100009993495 [0,2,0,0,0,0|2,0,0]=4 7149 B12R1.1000 C=C(C)c1c(cc(cc1Br)F)Br 271570a_100000694244_100009813983 [0,2,0,0,0,0|2,0,0]=4 7150 B12R1.1000 C=C(C)c1c(cc(cc1Br)F)C 271570a_100000694244_100010208209 [0,2,0,0,0,0|2,0,0]=4 7151 B12R1.1000 C=C(C)c1c(cc(cc1Br)F)Cl 271570a_100000694244_100012356682 [0,2,0,0,0,0|2,0,0]=4 7152 B12R1.1000 C=C(C)c1c(cc(cc1Br)F)F 271570a_100000694244_100000720994 [0,2,0,0,0,0|2,0,0]=4 7153 B12R1.1000 C=C(C)c1c(cc(cc1Br)F)N 271570a_100000694244_200010740111 [0,2,0,0,0,0|2,0,0]=4 7154 B12R1.1000 C=C(C)c1c(cc(cc1C)Br)C 271570a_100000694244_100009814048 [0,2,0,0,0,0|2,0,0]=4 7155 B12R1.1000 C=C(C)c1c(cc(cc1C)C)C 271570a_100000694244_100011204320 [0,2,0,0,0,0|1,0,0]=3 7156 B12R1.1000 C=C(C)c1c(cc(cc1C)Cl)C 271570a_100000694244_100010244930 [0,2,0,0,0,0|2,0,0]=4 7157 B12R1.1000 C=C(C)c1c(cc(cc1C)F)C 271570a_100000694244_100012356666 [0,2,0,0,0,0|2,0,0]=4 7158 B12R1.1000 C=C(C)c1c(cc(cc1C)O)C 271570a_100000694244_100000243743 [0,2,0,0,0,0|2,0,0]=4 7159 B12R1.1000 C=C(C)c1c(cc(cc1Cl)Br)Cl 271570a_100000694244_200011263224 [0,2,0,0,0,0|2,0,0]=4 7160 B12R1.1000 C=C(C)c1c(cc(cc1Cl)Br)F 271570a_100000694244_100010212234 [0,2,0,0,0,0|2,0,0]=4 7161 B12R1.1000 C=C(C)c1c(cc(cc1Cl)Cl)C 271570a_100000694244_200000035511 [0,2,0,0,0,0|2,0,0]=4 7162 B12R1.1000 C=C(C)c1c(cc(cc1Cl)Cl)Cl 271570a_100000694244_200011216440 [0,2,0,0,0,0|2,0,0]=4 7163 B12R1.1000 C=C(C)c1c(cc(cc1Cl)F)C 271570a_100000694244_100010079234 [0,2,0,0,0,0|2,0,0]=4 7164 B12R1.1000 C=C(C)c1c(cc(cc1Cl)F)Cl 271570a_100000694244_100010175091 [0,2,0,0,0,0|2,0,0]=4 7165 B12R1.1000 C=C(C)c1c(cc(cc1Cl)N)F 271570a_100000694244_100014833993 [0,2,0,0,0,0|2,0,0]=4 7166 B12R1.1000 C=C(C)c1c(cc(cc1F)Br)F 271570a_100000694244_100009813614 [0,2,0,0,0,0|2,0,0]=4 7167 B12R1.1000 C=C(C)c1c(cc(cc1F)C)F 271570a_100000694244_100015306127 [0,2,0,0,0,0|1,0,0]=3 7168 B12R1.1000 C=C(C)c1c(cc(cc1F)C)N 271570a_100000694244_100021129147 [0,2,0,0,0,0|1,0,0]=3 7169 B12R1.1000 C=C(C)c1c(cc(cc1F)Cl)N 271570a_100000694244_200021297760 [0,2,0,0,0,0|2,0,0]=4 7170 B12R1.1000 C=C(C)c1c(cc(cc1F)F)F 271570a_100000694244_100000243675 [0,2,0,0,0,0|2,0,0]=4 7171 B12R1.1000 C=C(C)c1c(cc(cc1F)F)N 271570a_100000694244_100000716482 [0,2,0,0,0,0|2,0,0]=4 7172 B12R1.1000 C=C(C)c1c(cc(cc1F)F)O 271570a_100000694244_100009815984 [0,2,0,0,0,0|2,0,0]=4 7173 B12R1.1000 C=C(C)c1c(cc(cc1F)O)F 271570a_100000694244_100010219129 [0,2,0,0,0,0|2,0,0]=4 7174 B12R1.1000 C=C(C)c1c(cc(cc1N)Cl)C 271570a_100000694244_100000698757 [0,2,0,0,0,0|2,0,0]=4 7175 B12R1.1000 C=C(C)c1c(cc(cc1O)C)C 271570a_100000694244_100010342985 [0,2,0,0,0,0|1,0,0]=3 7176 B12R1.1000 C=C(C)c1c(cc(cc1O)Cl)C 271570a_100000694244_100010254216 [0,2,0,0,0,0|2,0,0]=4 7177 B12R1.1000 C=C(C)c1c(cc(cc1O)O)O 271570a_100000694244_200010341185 [0,2,0,0,0,0|2,0,0]=4 7178 B12R1.1000 C=C(C)c1c(cc(nc1C)C)N 271570a_100000694244_100010261885 [0,2,0,0,0,0|2,0,0]=4 7179 B12R1.1000 CC(=O)c1c(cc(cc1Br)Br)Br 1458a_100011217931_200000210301 [0,2,0,0,0,0|1,0,0]=3 7180 B12R1.1000 CC(=O)c1c(cc(cc1Br)Br)F 1458a_100009813784_200000210301 [0,2,0,0,0,0|1,0,0]=3 7181 B12R1.1000 CC(=O)c1c(cc(cc1Br)C)F 1458a_100010768510_200000210301 [0,2,0,0,0,0|0,0,0]=2 7182 B12R1.1000 CC(=O)c1c(cc(cc1Br)Cl)F 1458a_100010244364_200000210301 [0,2,0,0,0,0|1,0,0]=3 7183 B12R1.1000 CC(=O)c1c(cc(cc1Br)F)Br 1458a_200015320377_200000210301 [0,2,0,0,0,0|1,0,0]=3 7184 B12R1.1000 CC(=O)c1c(cc(cc1Br)F)C 1458a_100010204434_200000210301 [0,2,0,0,0,0|1,0,0]=3 7185 B12R1.1000 CC(=O)c1c(cc(cc1Br)F)F 1458a_100013316034_200000210301 [0,2,0,0,0,0|1,0,0]=3 7186 B12R1.1000 CC(=O)c1c(cc(cc1C)Br)C 1458a_100000739581_200000210301 [0,2,0,0,0,0|1,0,0]=3 7187 B12R1.1000 CC(=O)c1c(cc(cc1C)C)C 1458a_100000211658_200000210301 [0,2,0,0,0,0|0,0,0]=2 7188 B12R1.1000 CC(=O)c1c(cc(cc1C)Cl)C 1458a_100000088873_200000210301 [0,2,0,0,0,0|1,0,0]=3 7189 B12R1.1000 CC(=O)c1c(cc(cc1C)F)C 1458a_100012017201_200000210301 [0,2,0,0,0,0|1,0,0]=3 7190 B12R1.1000 CC(=O)c1c(cc(cc1C)O)C 1458a_100000066486_200000210301 [0,2,0,0,0,0|1,0,0]=3 7191 B12R1.1000 CC(=O)c1c(cc(cc1Cl)Br)C 1458a_100000698028_200000210301 [0,2,0,0,0,0|1,0,0]=3 7192 B12R1.1000 CC(=O)c1c(cc(cc1Cl)Br)Cl 1458a_100012360385_200000210301 [0,2,0,0,0,0|1,0,0]=3 7193 B12R1.1000 CC(=O)c1c(cc(cc1Cl)Br)F 1458a_100010078411_200000210301 [0,2,0,0,0,0|1,0,0]=3 7194 B12R1.1000 CC(=O)c1c(cc(cc1Cl)C)Cl 1458a_100009989429_200000210301 [0,2,0,0,0,0|0,0,0]=2 7195 B12R1.1000 CC(=O)c1c(cc(cc1Cl)Cl)Cl 1458a_100011215713_200000210301 [0,2,0,0,0,0|1,0,0]=3 7196 B12R1.1000 CC(=O)c1c(cc(cc1Cl)Cl)F 1458a_100010068318_200000210301 [0,2,0,0,0,0|1,0,0]=3 7197 B12R1.1000 CC(=O)c1c(cc(cc1Cl)F)Cl 1458a_100000703918_200000210301 [0,2,0,0,0,0|1,0,0]=3 7198 B12R1.1000 CC(=O)c1c(cc(cc1Cl)F)F 1458a_100000119028_200000210301 [0,2,0,0,0,0|1,0,0]=3 7199 B12R1.1000 CC(=O)c1c(cc(cc1Cl)I)Cl 1458a_100010740244_200000210301 [0,2,0,0,0,0|1,0,0]=3 7200 B12R1.1000 CC(=O)c1c(cc(cc1Cl)O)Cl 1458a_100010423397_200000210301 [0,2,0,0,0,0|1,0,0]=3 7201 B12R1.1000 CC(=O)c1c(cc(cc1F)Br)C 1458a_100000708665_200000210301 [0,2,0,0,0,0|1,0,0]=3 7202 B12R1.1000 CC(=O)c1c(cc(cc1F)Br)F 1458a_100000766946_200000210301 [0,2,0,0,0,0|1,0,0]=3 7203 B12R1.1000 CC(=O)c1c(cc(cc1F)Br)O 1458a_200015963038_200000210301 [0,2,0,0,0,0|1,0,0]=3 7204 B12R1.1000 CC(=O)c1c(cc(cc1F)C)F 1458a_100009878570_200000210301 [0,2,0,0,0,0|0,0,0]=2 7205 B12R1.1000 CC(=O)c1c(cc(cc1F)Cl)C 1458a_100010768517_200000210301 [0,2,0,0,0,0|1,0,0]=3 7206 B12R1.1000 CC(=O)c1c(cc(cc1F)Cl)F 1458a_100000062413_200000210301 [0,2,0,0,0,0|1,0,0]=3 7207 B12R1.1000 CC(=O)c1c(cc(cc1F)F)F 1458a_100000751013_200000210301 [0,2,0,0,0,0|1,0,0]=3 7208 B12R1.1000 CC(=O)c1c(cc(cc1F)F)O 1458a_100000746385_200000210301 [0,2,0,0,0,0|1,0,0]=3 7209 B12R1.1000 CC(=O)c1c(cc(cc1F)O)F 1458a_100000038755_200000210301 [0,2,0,0,0,0|1,0,0]=3 7210 B12R1.1000 CC(=O)c1c(cc(cc1F)O)F 271570a_203496583355_100012706838 [0,2,0,0,0,0|1,0,0]=3 7211 B12R1.1000 CC(=O)c1c(cc(cc1F)O)O 271570a_203496583355_100010734142 [0,2,0,0,0,0|1,0,0]=3 7212 B12R1.1000 CC(=O)c1c(cc(cc1I)C)I 1458a_200010371430_200000210301 [0,2,0,0,0,0|0,0,0]=2 7213 B12R1.1000 CC(=O)c1c(cc(cc1I)F)C 1458a_200010371433_200000210301 [0,2,0,0,0,0|1,0,0]=3 7214 B12R1.1000 CC(=O)c1c(cc(cc1O)C)C 1458a_100011255216_200000210301 [0,2,0,0,0,0|0,0,0]=2 7215 B12R1.1000 CC(=O)c1c(cc(cc1O)C)O 1458a_100000036929_200000210301 [0,2,0,0,0,0|0,0,0]=2 7216 B12R1.1000 CC(=O)c1c(cc(cc1O)O)C 1458a_200000061528_200000210301 [0,2,0,0,0,0|1,0,0]=3 7217 B12R1.1000 Cc1cc(c(c(c1)Br)C(=O)[13CH3])F 1458a_100010768510_200025704644 [0,2,0,0,0,0|0,0,0]=2 7218 B12R1.1000 Cc1cc(c(c(c1)C)C(=O)[13CH3])C 1458a_100000211658_200025704644 [0,2,0,0,0,0|0,0,0]=2 7219 B12R1.1000 Cc1cc(c(c(c1)C)N(C)C)C 2230a_200011806176_200000210301 [0,2,0,0,0,0|2,0,0]=4 7220 B12R1.1000 Cc1cc(c(c(c1)C)N(C)C)C 269982a_200011806176_200000210301 [0,2,0,0,0,0|2,0,0]=4 7221 B12R1.1000 Cc1cc(c(c(c1)C)N(C)C)C 34a_200011806176_200000210301 [0,2,0,0,0,0|2,0,0]=4 7222 B12R1.1000 Cc1cc(c(c(c1)C)N(C)[13CH3])C 2230a_200011806176_200025704644 [0,2,0,0,0,0|2,0,0]=4 7223 B12R1.1000 Cc1cc(c(c(c1)C)N(C)[13CH3])C 269982a_200011806176_200025704644 [0,2,0,0,0,0|2,0,0]=4 7224 B12R1.1000 Cc1cc(c(c(c1)C)N(C)[13CH3])C 34a_200011806176_200025704644 [0,2,0,0,0,0|2,0,0]=4 7225 B12R1.1000 Cc1cc(c(c(c1)Cl)C(=O)[13CH3])Cl 1458a_100009989429_200025704644 [0,2,0,0,0,0|0,0,0]=2 7226 B12R1.1000 Cc1cc(c(c(c1)F)C(=O)[13CH3])F 1458a_100009878570_200025704644 [0,2,0,0,0,0|0,0,0]=2 7227 B12R1.1000 Cc1cc(c(c(c1)I)C(=O)[13CH3])I 1458a_200010371430_200025704644 [0,2,0,0,0,0|0,0,0]=2 7228 B12R1.1000 Cc1cc(c(c(c1)O)C(=O)[13CH3])C 1458a_100011255216_200025704644 [0,2,0,0,0,0|0,0,0]=2 7229 B12R1.1000 Cc1cc(c(c(c1)O)C(=O)[13CH3])O 1458a_100000036929_200025704644 [0,2,0,0,0,0|0,0,0]=2 7230 B12R1.1000 Cc1cc(c(c(n1)O)C(=O)N)C 271570a_203496583355_100000017153 [0,2,0,0,0,0|2,0,0]=4 7231 B12R1.1000 Cc1cc(cc(c1C(=O)N)F)O 271570a_203496583355_100016096366 [0,2,0,0,0,0|2,0,0]=4 7232 B12R1.1000 Cc1cc(cc(c1C(=O)[13CH3])Br)F 1458a_100010204434_200025704644 [0,2,0,0,0,0|1,0,0]=3 7233 B12R1.1000 Cc1cc(cc(c1C(=O)[13CH3])C)Br 1458a_100000739581_200025704644 [0,2,0,0,0,0|1,0,0]=3 7234 B12R1.1000 Cc1cc(cc(c1C(=O)[13CH3])C)Cl 1458a_100000088873_200025704644 [0,2,0,0,0,0|1,0,0]=3 7235 B12R1.1000 Cc1cc(cc(c1C(=O)[13CH3])C)F 1458a_100012017201_200025704644 [0,2,0,0,0,0|1,0,0]=3 7236 B12R1.1000 Cc1cc(cc(c1C(=O)[13CH3])C)O 1458a_100000066486_200025704644 [0,2,0,0,0,0|1,0,0]=3 7237 B12R1.1000 Cc1cc(cc(c1C(=O)[13CH3])Cl)Br 1458a_100000698028_200025704644 [0,2,0,0,0,0|1,0,0]=3 7238 B12R1.1000 Cc1cc(cc(c1C(=O)[13CH3])F)Br 1458a_100000708665_200025704644 [0,2,0,0,0,0|1,0,0]=3 7239 B12R1.1000 Cc1cc(cc(c1C(=O)[13CH3])F)Cl 1458a_100010768517_200025704644 [0,2,0,0,0,0|1,0,0]=3 7240 B12R1.1000 Cc1cc(cc(c1C(=O)[13CH3])I)F 1458a_200010371433_200025704644 [0,2,0,0,0,0|1,0,0]=3 7241 B12R1.1000 Cc1cc(cc(c1C(=O)[13CH3])O)O 1458a_200000061528_200025704644 [0,2,0,0,0,0|1,0,0]=3 7242 B12R1.1000 NC(=O)c1c(cc(cc1F)O)F 271570a_203496583355_100000695656 [0,2,0,0,0,0|2,0,0]=4 7243 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1Br)Br)Br 1458a_100011217931_200025704644 [0,2,0,0,0,0|1,0,0]=3 7244 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1Br)Br)F 1458a_100009813784_200025704644 [0,2,0,0,0,0|1,0,0]=3 7245 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1Br)Cl)F 1458a_100010244364_200025704644 [0,2,0,0,0,0|1,0,0]=3 7246 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1Br)F)Br 1458a_200015320377_200025704644 [0,2,0,0,0,0|1,0,0]=3 7247 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1Br)F)F 1458a_100013316034_200025704644 [0,2,0,0,0,0|1,0,0]=3 7248 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1Cl)Br)Cl 1458a_100012360385_200025704644 [0,2,0,0,0,0|1,0,0]=3 7249 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1Cl)Br)F 1458a_100010078411_200025704644 [0,2,0,0,0,0|1,0,0]=3 7250 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1Cl)Cl)Cl 1458a_100011215713_200025704644 [0,2,0,0,0,0|1,0,0]=3 7251 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1Cl)Cl)F 1458a_100010068318_200025704644 [0,2,0,0,0,0|1,0,0]=3 7252 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1Cl)F)Cl 1458a_100000703918_200025704644 [0,2,0,0,0,0|1,0,0]=3 7253 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1Cl)F)F 1458a_100000119028_200025704644 [0,2,0,0,0,0|1,0,0]=3 7254 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1Cl)I)Cl 1458a_100010740244_200025704644 [0,2,0,0,0,0|1,0,0]=3 7255 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1Cl)O)Cl 1458a_100010423397_200025704644 [0,2,0,0,0,0|1,0,0]=3 7256 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1F)Br)F 1458a_100000766946_200025704644 [0,2,0,0,0,0|1,0,0]=3 7257 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1F)Br)O 1458a_200015963038_200025704644 [0,2,0,0,0,0|1,0,0]=3 7258 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1F)Cl)F 1458a_100000062413_200025704644 [0,2,0,0,0,0|1,0,0]=3 7259 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1F)F)F 1458a_100000751013_200025704644 [0,2,0,0,0,0|1,0,0]=3 7260 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1F)F)O 1458a_100000746385_200025704644 [0,2,0,0,0,0|1,0,0]=3 7261 B12R1.1000 [13CH3]C(=O)c1c(cc(cc1F)O)F 1458a_100000038755_200025704644 [0,2,0,0,0,0|1,0,0]=3 7262 B10R1.54 CC(=Cc1cc(cs1)C)C 271570a_100102525489_100009876951 [0,0,1,1,0,0|2,0,0]=4 7263 B10R1.54 CC(=Cc1ccc(s1)C)C 271570a_100102525489_100000761539 [0,0,1,1,0,0|2,0,0]=4 7264 B10R1.54 CC(=Cc1csc(c1)C)C 271570a_100102525489_100000759034 [0,0,1,1,0,0|2,0,0]=4 7265 B10R1.35 C=Cc1cc(sc1C)C=O 271570a_100011290941_100000708457 [0,0,1,1,0,0|1,1,0]=4 7266 B10R2.31 Oc1ccc2c(c1)CC2 271570a_203496583355_100009818592 [1,0,0,1,0,0|1,0,1]=4 7267 B10R2.6 c1ccc(cc1)C2CC2 271570a_100011220607_100000210277 [1,0,0,1,0,0|1,0,1]=4 7268 B12R2.294 Cc1ccc(cc1)NC2CC2 34a_100000124888_100000211595 [0,0,0,1,0,1|1,0,1]=4 7269 B12R2.294 Cc1ccc(cc1)OC2CC2 34a_100000210336_100000211595 [0,0,0,1,0,1|1,0,1]=4 7270 B12R2.294 Cc1ccc(cc1)SC2CC2 62a_100000186775_100000211595 [0,0,0,1,0,1|1,0,1]=4 7271 B12R2.606 Cc1cc2cc(ccc2[nH]1)O 271570a_203496583355_100011214893 [0,0,0,1,0,1|2,0,0]=4 7272 B12R2.606 Cc1cc2cc(ccc2s1)O 271570a_203496583355_100000695401 [0,0,0,1,0,1|2,0,0]=4 7273 B12R2.606 Cc1cc2ccc(cc2[nH]1)O 271570a_203496583355_100010196937 [0,0,0,1,0,1|2,0,0]=4 7274 B12R2.606 Cc1ccc2nc(sc2c1)O 271570a_203496583355_100010186437 [0,0,0,1,0,1|1,0,1]=4 7275 B12R2.606 Cc1nc2cc(ccc2[nH]1)O 271570a_203496583355_100011264012 [0,0,0,1,0,1|2,0,0]=4 7276 B12R2.606 Cc1nc2cc(ccc2o1)O 271570a_203496583355_100009816932 [0,0,0,1,0,1|2,0,0]=4 7277 B12R2.606 Cc1nc2cc(ccc2s1)O 271570a_203496583355_100009813953 [0,0,0,1,0,1|2,0,0]=4 7278 B12R2.606 Cc1nc2ccc(cc2o1)O 271570a_203496583355_100010171164 [0,0,0,1,0,1|1,0,1]=4 7279 B12R2.606 Cc1nc2ccc(cc2s1)O 271570a_203496583355_100009813144 [0,0,0,1,0,1|1,1,0]=4 7280 B12R2.606 O=C1Cc2cc(ccc2N1)O 271570a_203496583355_100000754858 [0,0,0,1,0,1|1,0,0]=3 7281 B12R2.606 O=C1Cc2cc(cnc2N1)O 271570a_203496583355_100010177629 [0,0,0,1,0,1|2,0,0]=4 7282 B12R2.606 O=C1Cc2cc(ncc2N1)O 271570a_203496583355_100000104063 [0,0,0,1,0,1|2,0,0]=4 7283 B12R2.606 O=C1Cc2ccc(cc2C1)O 271570a_203496583355_100010185598 [0,0,0,1,0,1|1,0,0]=3 7284 B12R2.606 O=C1Cc2ccc(cc2N1)O 271570a_203496583355_100000760487 [0,0,0,1,0,1|2,0,0]=4 7285 B12R2.606 O=C1Cc2nc(ccc2N1)O 271570a_203496583355_100000087150 [0,0,0,1,0,1|2,0,0]=4 7286 B12R2.606 O=c1[nH]c2cc(ccc2o1)O 271570a_203496583355_100000764829 [0,0,0,1,0,1|2,0,0]=4 7287 B12R2.606 O=c1[nH]c2cc(ccc2s1)O 271570a_203496583355_100000239354 [0,0,0,1,0,1|2,0,0]=4 7288 B12R2.606 O=c1[nH]c2ccc(cc2[nH]1)O 271570a_203496583355_100011221360 [0,0,0,1,0,1|2,0,0]=4 7289 B12R2.606 O=c1[nH]c2ccc(cc2o1)O 271570a_203496583355_100000697996 [0,0,0,1,0,1|2,0,0]=4 7290 B12R2.606 O=c1[nH]c2ccc(cc2s1)O 271570a_203496583355_100009813980 [0,0,0,1,0,1|2,0,0]=4 7291 B12R2.9 CCc1ccc(cc1)C2CC2 271570a_100011220607_100011215824 [0,1,0,1,0,0|1,0,1]=4 7292 B12R2.9 CNc1ccc(cc1)C2CC2 271570a_100011220607_100000219623 [0,1,0,1,0,0|1,0,1]=4 7293 B12R2.9 CNc1ccc(cc1)C2CC2 34a_100016991203_200000210301 [0,1,0,1,0,0|1,0,1]=4 7294 B12R2.9 COc1ccc(cc1)C2CC2 271570a_100011220607_100000171711 [0,1,0,1,0,0|1,0,1]=4 7295 B12R2.9 COc1ccc(cc1)C2CC2 34a_100011997980_200000210301 [0,1,0,1,0,0|1,0,1]=4 7296 B12R2.9 COc1ccc(cc1)C2CC2 7a_100011997980_200000210301 [0,1,0,1,0,0|1,0,1]=4 7297 B12R2.9 CSc1ccc(cc1)C2CC2 271570a_100011220607_100011263217 [0,1,0,1,0,0|1,0,1]=4 7298 B12R2.9 CSc1ccc(cc1)C2CC2 62a_200000210301_100009820665 [0,1,0,1,0,0|1,0,1]=4 7299 B12R2.9 FCc1ccc(cc1)C2CC2 271570a_100011220607_100010268989 [0,1,0,1,0,0|1,0,1]=4 7300 B12R2.9 NCc1ccc(cc1)C2CC2 271570a_100011220607_100016989417 [0,1,0,1,0,0|1,0,1]=4 7301 B12R2.9 OCc1ccc(cc1)C2CC2 271570a_100011220607_100000690907 [0,1,0,1,0,0|1,0,1]=4 7302 B12R2.9 [13CH3]Nc1ccc(cc1)C2CC2 34a_100016991203_200025704644 [0,1,0,1,0,0|1,0,1]=4 7303 B12R2.9 [13CH3]Oc1ccc(cc1)C2CC2 34a_100011997980_200025704644 [0,1,0,1,0,0|1,0,1]=4 7304 B12R2.9 [13CH3]Oc1ccc(cc1)C2CC2 7a_100011997980_200025704644 [0,1,0,1,0,0|1,0,1]=4 7305 B12R2.9 [13CH3]Sc1ccc(cc1)C2CC2 62a_200025704644_100009820665 [0,1,0,1,0,0|1,0,1]=4 7306 B12R2.1384 C=C(C)c1ccc2c(c1)CC2 271570a_100000694244_100009818592 [0,1,0,1,0,0|1,0,0]=3 7307 B12R2.1384 CC(=O)c1ccc2c(c1)CC2 1458a_100000137882_200000210301 [0,1,0,1,0,0|0,0,0]=2 7308 B12R2.1384 [13CH3]C(=O)c1ccc2c(c1)CC2 1458a_100000137882_200025704644 [0,1,0,1,0,0|0,0,0]=2 7309 B12R2.291 Cc1ccc(cc1Br)C2CC2 271570a_100011220607_100011847877 [0,1,0,1,0,0|1,0,1]=4 7310 B12R2.291 Cc1ccc(cc1C)C2CC2 271570a_100011220607_100011215607 [0,1,0,1,0,0|1,0,1]=4 7311 B12R2.291 Cc1ccc(cc1Cl)C2CC2 271570a_100011220607_100011216363 [0,1,0,1,0,0|1,0,1]=4 7312 B12R2.291 Cc1ccc(cc1F)C2CC2 271570a_100011220607_100000720648 [0,1,0,1,0,0|1,0,1]=4 7313 B12R2.291 Cc1ccc(cc1N)C2CC2 271570a_100011220607_100000761890 [0,1,0,1,0,0|1,0,1]=4 7314 B12R2.291 Cc1ccc(cc1O)C2CC2 271570a_100011220607_100000766334 [0,1,0,1,0,0|1,0,1]=4 7315 B12R2.612 Cc1c[nH]c2c1ccc(c2)O 271570a_203496583355_100010209589 [0,1,0,1,0,0|2,0,0]=4 7316 B12R2.612 Cc1ccc2c(n[nH]c2c1)O 271570a_203496583355_100000049534 [0,1,0,1,0,0|1,0,1]=4 7317 B12R2.612 Cc1coc2c1ccc(c2)O 271570a_203496583355_100010775837 [0,1,0,1,0,0|1,0,1]=4 7318 B12R2.612 Cc1n[nH]c2c1ccc(c2)O 271570a_203496583355_100009816850 [0,1,0,1,0,0|2,0,0]=4 7319 B12R2.612 Cc1noc2c1ccc(c2)O 271570a_203496583355_100009815287 [0,1,0,1,0,0|1,0,1]=4 7320 B12R2.612 O=C1C=Cc2c1ccc(c2)O 271570a_203496583355_100010210589 [0,1,0,1,0,0|1,0,1]=4 7321 B12R2.612 O=C1CCc2c1ccc(c2)O 271570a_203496583355_100000737041 [0,1,0,1,0,0|1,0,0]=3 7322 B12R2.612 O=C1COc2c1ccc(c2)O 271570a_203496583355_100000686717 [0,1,0,1,0,0|1,0,0]=3 7323 B12R2.612 O=C1NCc2c1ccc(c2)O 271570a_203496583355_100000692135 [0,1,0,1,0,0|1,0,0]=3 7324 B12R2.612 O=C1NCc2c1ccc(n2)O 271570a_203496583355_200009864240 [0,1,0,1,0,0|2,0,0]=4 7325 B12R2.612 O=C1OCc2c1ccc(c2)O 271570a_203496583355_100009816608 [0,1,0,1,0,0|1,0,0]=3 7326 B12R2.612 O=c1[nH][nH]c2c1ccc(c2)O 271570a_203496583355_100012353722 [0,1,0,1,0,0|2,0,0]=4 7327 B12R2.1317 Cc1ccc(c(c1)Br)C2CC2 271570a_100011220607_100009813563 [0,1,0,1,0,0|1,0,1]=4 7328 B12R2.1317 Cc1ccc(c(c1)C)C2CC2 271570a_100011220607_100011217332 [0,1,0,1,0,0|1,0,1]=4 7329 B12R2.1317 Cc1ccc(c(c1)Cl)C2CC2 271570a_100011220607_100011263221 [0,1,0,1,0,0|1,0,1]=4 7330 B12R2.1317 Cc1ccc(c(c1)F)C2CC2 271570a_100011220607_100011216119 [0,1,0,1,0,0|1,0,1]=4 7331 B12R2.1317 Cc1ccc(c(c1)N)C2CC2 271570a_100011220607_100011216686 [0,1,0,1,0,0|1,0,1]=4 7332 B12R2.1317 Cc1ccc(c(c1)O)C2CC2 271570a_100011220607_100012002257 [0,1,0,1,0,0|1,0,1]=4 7333 B8R1.1 C=Cc1cc(cs1)C 271570a_100011290941_100009876951 [1,0,0,0,1,0|1,0,1]=4 7334 B8R1.1 C=Cc1ccc(s1)C 271570a_100011290941_100000761539 [1,0,0,0,1,0|1,0,1]=4 7335 B8R1.1 C=Cc1csc(c1)C 271570a_100011290941_100000759034 [1,0,0,0,1,0|1,0,1]=4 7336 B8R1.1 CSc1cc(cs1)C 62a_100009876951_200000210301 [1,0,0,0,1,0|2,0,0]=4 7337 B8R1.1 CSc1cc(cs1)C 62a_200000210301_100009876951 [1,0,0,0,1,0|2,0,0]=4 7338 B8R1.1 CSc1ccc(s1)C 62a_100000031368_200000210301 [1,0,0,0,1,0|2,0,0]=4 7339 B8R1.1 CSc1ccc(s1)C 62a_200000210301_100000031368 [1,0,0,0,1,0|2,0,0]=4 7340 B8R1.1 CSc1csc(c1)C 62a_100000759034_200000210301 [1,0,0,0,1,0|2,0,0]=4 7341 B8R1.1 CSc1csc(c1)C 62a_200000210301_100000759034 [1,0,0,0,1,0|2,0,0]=4 7342 B8R1.1 Cc1cc(cs1)S[13CH3] 62a_100000759034_200025704644 [1,0,0,0,1,0|2,0,0]=4 7343 B8R1.1 Cc1cc(cs1)S[13CH3] 62a_200025704644_100000759034 [1,0,0,0,1,0|2,0,0]=4 7344 B8R1.1 Cc1ccc(s1)S[13CH3] 62a_100000031368_200025704644 [1,0,0,0,1,0|2,0,0]=4 7345 B8R1.1 Cc1ccc(s1)S[13CH3] 62a_200025704644_100000031368 [1,0,0,0,1,0|2,0,0]=4 7346 B8R1.1 Cc1csc(c1)S[13CH3] 62a_100009876951_200025704644 [1,0,0,0,1,0|2,0,0]=4 7347 B8R1.1 Cc1csc(c1)S[13CH3] 62a_200025704644_100009876951 [1,0,0,0,1,0|2,0,0]=4 7348 B8R1.1 O=Cc1c[nH]c(c1)O 271570a_203496583355_100009882863 [1,0,0,0,1,0|2,0,0]=4 7349 B8R1.1 O=Cc1cc(co1)O 271570a_203496583355_100000747035 [1,0,0,0,1,0|2,0,0]=4 7350 B8R1.1 O=Cc1cc(cs1)O 271570a_203496583355_100000211722 [1,0,0,0,1,0|2,0,0]=4 7351 B8R1.1 O=Cc1ccc(o1)O 271570a_203496583355_100000185145 [1,0,0,0,1,0|2,0,0]=4 7352 B8R1.1 O=Cc1ccc(s1)O 271570a_203496583355_100000179771 [1,0,0,0,1,0|2,0,0]=4 7353 B8R1.1 O=Cc1csc(c1)O 271570a_203496583355_100000737087 [1,0,0,0,1,0|2,0,0]=4 7354 B8R1.7 C=C(C)c1ccco1 271570a_100000694244_100009814098 [1,0,0,0,1,0|2,0,0]=4 7355 B8R1.7 C=C(C)c1cccs1 271570a_100000694244_100011215356 [1,0,0,0,1,0|2,0,0]=4 7356 B8R1.7 C=C(C)c1ccoc1 271570a_100000694244_100011215275 [1,0,0,0,1,0|2,0,0]=4 7357 B8R1.7 C=C(C)c1ccsc1 271570a_100000694244_100000738268 [1,0,0,0,1,0|2,0,0]=4 7358 B10R1.18 CC(=Cc1ccccc1)C 271570a_100102525489_100000210277 [1,0,0,0,0,1|1,0,0]=3 7359 B10R1.18 CC(=Cc1ccccn1)C 271570a_100102525489_100011216584 [1,0,0,0,0,1|2,0,0]=4 7360 B10R1.18 CC(=Cc1cccnc1)C 271570a_100102525489_100000752921 [1,0,0,0,0,1|2,0,0]=4 7361 B10R1.18 CC(=Cc1ccncc1)C 271570a_100102525489_100000035832 [1,0,0,0,0,1|2,0,0]=4 7362 B10R1.18 CC(=O)C[n+]1ccccc1 1458a_200000086051_200000210301 [1,0,0,0,0,1|1,0,0]=3 7363 B10R1.18 CC(=O)Cc1ccccc1 1458a_100000070787_100015291786 [1,0,0,0,0,1|0,0,0]=2 7364 B10R1.18 CC(=O)Cc1ccccn1 1458a_100000070787_100000721315 [1,0,0,0,0,1|1,0,0]=3 7365 B10R1.18 CC(=O)Cc1ccccn1 1458a_100000233486_200000210301 [1,0,0,0,0,1|1,0,0]=3 7366 B10R1.18 CC(=O)Cc1cccnc1 1458a_100000070787_100000733263 [1,0,0,0,0,1|1,0,0]=3 7367 B10R1.18 CC(=O)Cc1cccnc1 1458a_100000737805_200000210301 [1,0,0,0,0,1|1,0,0]=3 7368 B10R1.18 CC(=O)Cc1cccnn1 1458a_100000070787_100016990269 [1,0,0,0,0,1|2,0,0]=4 7369 B10R1.18 CC(=O)Cc1ccncc1 1458a_100000070787_100000705612 [1,0,0,0,0,1|1,0,0]=3 7370 B10R1.18 CC(=O)Cc1cnccn1 1458a_100000070787_100016995436 [1,0,0,0,0,1|2,0,0]=4 7371 B10R1.18 CC(=O)Cc1cncnc1 1458a_100000070787_100015196519 [1,0,0,0,0,1|2,0,0]=4 7372 B10R1.18 CC(=O)Cc1cncnc1 1458a_100000721575_200000210301 [1,0,0,0,0,1|2,0,0]=4 7373 B10R1.18 CC(=O)Cc1ncccn1 1458a_100000070787_100000703007 [1,0,0,0,0,1|2,0,0]=4 7374 B10R1.18 CC(=O)Nc1ccccc1 11a_100000106764_100015343762 [1,0,0,0,0,1|0,0,0]=2 7375 B10R1.18 CC(=O)Nc1ccccc1 1626a_100000106764_100015343762 [1,0,0,0,0,1|0,0,0]=2 7376 B10R1.18 CC(=O)Nc1ccccc1 22a_100000106764_100000070787 [1,0,0,0,0,1|0,0,0]=2 7377 B10R1.18 CC(=O)Nc1ccccc1 527a_100000106764_100103153847 [1,0,0,0,0,1|0,0,0]=2 7378 B10R1.18 CC(C)Nc1ccccc1 34a_100000106764_100000210206 [1,0,0,0,0,1|1,0,1]=4 7379 B10R1.18 CC(C)Oc1ccccc1 34a_100000210340_100000210206 [1,0,0,0,0,1|1,0,1]=4 7380 B10R1.18 CC(C)Oc1ccccc1 7a_100000210340_100000210206 [1,0,0,0,0,1|1,0,1]=4 7381 B10R1.18 CC(C)Sc1ccccc1 62a_100000210206_100000041952 [1,0,0,0,0,1|1,0,1]=4 7382 B10R1.18 CC(C)Sc1ccccc1 62a_100000719477_100000210206 [1,0,0,0,0,1|1,0,1]=4 7383 B10R1.18 CN(C)Cc1ccccc1 2230a_100000186898_200000210301 [1,0,0,0,0,1|2,0,0]=4 7384 B10R1.18 CN(C)Cc1ccccc1 2230a_100102631434_100015291786 [1,0,0,0,0,1|2,0,0]=4 7385 B10R1.18 CN(C)Cc1ccccc1 269982a_100000186898_200000210301 [1,0,0,0,0,1|2,0,0]=4 7386 B10R1.18 CN(C)Cc1ccccc1 269982a_100102631434_100000211182 [1,0,0,0,0,1|2,0,0]=4 7387 B10R1.18 CN(C)Cc1ccccc1 270004a_100102631434_100015611070 [1,0,0,0,0,1|2,0,0]=4 7388 B10R1.18 CN([13CH3])Cc1ccccc1 2230a_100000186898_200025704644 [1,0,0,0,0,1|2,0,0]=4 7389 B10R1.18 CN([13CH3])Cc1ccccc1 269982a_100000186898_200025704644 [1,0,0,0,0,1|2,0,0]=4 7390 B10R1.18 [13CH3]C(=O)C[n+]1ccccc1 1458a_200000086051_200025704644 [1,0,0,0,0,1|1,0,0]=3 7391 B10R1.18 [13CH3]C(=O)Cc1ccccn1 1458a_100000233486_200025704644 [1,0,0,0,0,1|1,0,0]=3 7392 B10R1.18 [13CH3]C(=O)Cc1cccnc1 1458a_100000737805_200025704644 [1,0,0,0,0,1|1,0,0]=3 7393 B10R1.18 [13CH3]C(=O)Cc1cncnc1 1458a_100000721575_200025704644 [1,0,0,0,0,1|2,0,0]=4 7394 B12R1.21 C=C(C)CNc1ccc(cc1)Br 2230a_100000210018_100000748629 [0,0,0,0,0,2|2,0,0]=4 7395 B12R1.21 C=C(C)CNc1ccc(cc1)Br 34a_100000210018_100000748629 [0,0,0,0,0,2|2,0,0]=4 7396 B12R1.21 C=C(C)CNc1ccc(cc1)C 34a_100000124888_100000748629 [0,0,0,0,0,2|1,0,0]=3 7397 B12R1.21 C=C(C)CNc1ccc(cc1)Cl 2230a_100000210052_100000748629 [0,0,0,0,0,2|2,0,0]=4 7398 B12R1.21 C=C(C)CNc1ccc(cc1)Cl 34a_100000210052_100000748629 [0,0,0,0,0,2|2,0,0]=4 7399 B12R1.21 C=C(C)CNc1ccc(cc1)F 34a_100000185862_100000748629 [0,0,0,0,0,2|2,0,0]=4 7400 B12R1.21 C=C(C)CNc1ccc(cc1)I 34a_100000185761_100000748629 [0,0,0,0,0,2|2,0,0]=4 7401 B12R1.21 C=C(C)CNc1ccc(cc1)O 34a_100000185829_100000748629 [0,0,0,0,0,2|2,0,0]=4 7402 B12R1.21 C=C(C)COc1ccc(cc1)Br 34a_100000185759_100000748629 [0,0,0,0,0,2|2,0,0]=4 7403 B12R1.21 C=C(C)COc1ccc(cc1)Br 7a_100000185759_100000748629 [0,0,0,0,0,2|2,0,0]=4 7404 B12R1.21 C=C(C)COc1ccc(cc1)C 34a_100000210336_100000748629 [0,0,0,0,0,2|1,0,0]=3 7405 B12R1.21 C=C(C)COc1ccc(cc1)C 7a_100000210336_100000748629 [0,0,0,0,0,2|1,0,0]=3 7406 B12R1.21 C=C(C)COc1ccc(cc1)Cl 34a_100000210216_100000748629 [0,0,0,0,0,2|2,0,0]=4 7407 B12R1.21 C=C(C)COc1ccc(cc1)Cl 7a_100000210216_100000748629 [0,0,0,0,0,2|2,0,0]=4 7408 B12R1.21 C=C(C)COc1ccc(cc1)F 34a_100000210339_100000748629 [0,0,0,0,0,2|2,0,0]=4 7409 B12R1.21 C=C(C)COc1ccc(cc1)I 34a_100000212066_100000748629 [0,0,0,0,0,2|2,0,0]=4 7410 B12R1.21 C=C(C)COc1ccc(cc1)I 7a_100000212066_100000748629 [0,0,0,0,0,2|2,0,0]=4 7411 B12R1.21 C=C(C)COc1ccc(cc1)N 34a_100000185829_100000748629 [0,0,0,0,0,2|2,0,0]=4 7412 B12R1.21 C=C(C)COc1ccc(cn1)C 34a_100000759353_100000748629 [0,0,0,0,0,2|2,0,0]=4 7413 B12R1.21 C=C(C)COc1ccc(nc1)C 34a_100000745506_100000748629 [0,0,0,0,0,2|2,0,0]=4 7414 B12R1.21 C=C(C)COc1ccc(nc1)C 7a_100000745506_100000748629 [0,0,0,0,0,2|2,0,0]=4 7415 B12R1.21 C=C(C)CSc1ccc(cc1)Br 62a_100000748629_100000752885 [0,0,0,0,0,2|2,0,0]=4 7416 B12R1.21 C=C(C)CSc1ccc(cc1)Br 62a_100000752885_100000211660 [0,0,0,0,0,2|2,0,0]=4 7417 B12R1.21 C=C(C)CSc1ccc(cc1)C 62a_100000186775_100000211660 [0,0,0,0,0,2|1,0,0]=3 7418 B12R1.21 C=C(C)CSc1ccc(cc1)C 62a_100000748629_100000186775 [0,0,0,0,0,2|1,0,0]=3 7419 B12R1.21 C=C(C)CSc1ccc(cc1)Cl 62a_100000748629_100000755918 [0,0,0,0,0,2|2,0,0]=4 7420 B12R1.21 C=C(C)CSc1ccc(cc1)Cl 62a_100000755918_100000211660 [0,0,0,0,0,2|2,0,0]=4 7421 B12R1.21 C=C(C)CSc1ccc(cc1)F 62a_100000211213_100000211660 [0,0,0,0,0,2|2,0,0]=4 7422 B12R1.21 C=C(C)CSc1ccc(cc1)F 62a_100000748629_100000211213 [0,0,0,0,0,2|2,0,0]=4 7423 B12R1.21 C=C(C)CSc1ccc(cc1)N 62a_100000185761_100000211660 [0,0,0,0,0,2|2,0,0]=4 7424 B12R1.21 C=C(C)CSc1ccc(cc1)N 62a_100000748629_100000185761 [0,0,0,0,0,2|2,0,0]=4 7425 B12R1.21 C=C(C)CSc1ccc(cc1)O 62a_100000748629_100000185759 [0,0,0,0,0,2|2,0,0]=4 7426 B12R1.21 C=C(C)CSc1ccc(cn1)C 62a_100000748629_100000754016 [0,0,0,0,0,2|2,0,0]=4 7427 B12R1.21 C=C(C)CSc1ccc(cn1)C 62a_100011192072_100000211660 [0,0,0,0,0,2|2,0,0]=4 7428 B12R1.21 C=C(C)CSc1ccc(nc1)C 62a_100000748629_100000751577 [0,0,0,0,0,2|2,0,0]=4 7429 B12R1.21 C=C(C)CSc1ccc(nc1)C 62a_100000751577_100000211660 [0,0,0,0,0,2|2,0,0]=4 7430 B12R1.21 C=C(F)CNc1ccc(cc1)C 34a_100000124888_100009893438 [0,0,0,0,0,2|1,0,1]=4 7431 B12R1.21 C=C(F)COc1ccc(cc1)C 34a_100000210336_100009893438 [0,0,0,0,0,2|1,0,1]=4 7432 B12R1.21 C=C(F)COc1ccc(cc1)C 7a_100000210336_100000042424 [0,0,0,0,0,2|1,0,1]=4 7433 B12R1.21 C=C(F)CSc1ccc(cc1)C 62a_100000042424_100000186775 [0,0,0,0,0,2|1,0,1]=4 7434 B12R1.21 C=C(F)CSc1ccc(cc1)C 62a_100000186775_100000042424 [0,0,0,0,0,2|1,0,1]=4 7435 B12R1.21 CC(=O)/C=C/c1ccc(cc1)O 271570a_203496583355_200016259395 [0,0,0,0,0,2|1,0,0]=3 7436 B12R1.21 CC(=O)C#Cc1ccc(cc1)Br 1458a_100012100275_200000210301 [0,0,0,0,0,2|1,0,0]=3 7437 B12R1.21 CC(=O)C#Cc1ccc(cc1)Cl 1458a_100011892723_200000210301 [0,0,0,0,0,2|1,0,0]=3 7438 B12R1.21 CC(=O)C#Cc1ccc(cc1)F 1458a_100000238512_200000210301 [0,0,0,0,0,2|1,0,0]=3 7439 B12R1.21 CC(=O)C=Cc1ccc(cc1)Br 1458a_100016267368_200000210301 [0,0,0,0,0,2|1,0,0]=3 7440 B12R1.21 CC(=O)C=Cc1ccc(cc1)C 1458a_100000716854_200000210301 [0,0,0,0,0,2|0,0,0]=2 7441 B12R1.21 CC(=O)C=Cc1ccc(cc1)Cl 1458a_100000184863_200000210301 [0,0,0,0,0,2|1,0,0]=3 7442 B12R1.21 CC(=O)C=Cc1ccc(cc1)F 1458a_100000182136_200000210301 [0,0,0,0,0,2|1,0,0]=3 7443 B12R1.21 CC(=O)C=Cc1ccc(cc1)I 1458a_100102526154_200000210301 [0,0,0,0,0,2|1,0,0]=3 7444 B12R1.21 CC(=O)C=Cc1ccc(cn1)F 1458a_100020630499_200000210301 [0,0,0,0,0,2|2,0,0]=4 7445 B12R1.21 CC(=O)C=Cc1ccc(nc1)Br 1458a_100020588214_200000210301 [0,0,0,0,0,2|2,0,0]=4 7446 B12R1.21 CC(=O)CCc1ccc(cc1)Br 1458a_100000070787_100011740612 [0,0,0,0,0,2|1,0,0]=3 7447 B12R1.21 CC(=O)CCc1ccc(cc1)Br 1458a_100000217147_200000210301 [0,0,0,0,0,2|1,0,0]=3 7448 B12R1.21 CC(=O)CCc1ccc(cc1)C 1458a_100000070787_100011713686 [0,0,0,0,0,2|0,0,0]=2 7449 B12R1.21 CC(=O)CCc1ccc(cc1)C 1458a_100000234883_200000210301 [0,0,0,0,0,2|0,0,0]=2 7450 B12R1.21 CC(=O)CCc1ccc(cc1)Cl 1458a_100000070787_100011713675 [0,0,0,0,0,2|1,0,0]=3 7451 B12R1.21 CC(=O)CCc1ccc(cc1)Cl 1458a_100000235379_200000210301 [0,0,0,0,0,2|1,0,0]=3 7452 B12R1.21 CC(=O)CCc1ccc(cc1)F 1458a_100000070787_100011217392 [0,0,0,0,0,2|1,0,0]=3 7453 B12R1.21 CC(=O)CCc1ccc(cc1)F 1458a_100000198493_200000210301 [0,0,0,0,0,2|1,0,0]=3 7454 B12R1.21 CC(=O)CCc1ccc(cc1)I 1458a_100011217499_200000210301 [0,0,0,0,0,2|1,0,0]=3 7455 B12R1.21 CC(=O)CCc1ccc(cc1)O 1458a_100000070787_100009816426 [0,0,0,0,0,2|1,0,0]=3 7456 B12R1.21 CC(=O)CCc1ccc(cc1)O 1458a_100000742835_200000210301 [0,0,0,0,0,2|1,0,0]=3 7457 B12R1.21 CC(=O)CCc1ccc(cc1)O 271570a_203496583355_100000723691 [0,0,0,0,0,2|1,0,0]=3 7458 B12R1.21 CC(=O)COc1ccc(cc1)Br 1458a_100000182358_200000210301 [0,0,0,0,0,2|1,0,0]=3 7459 B12R1.21 CC(=O)COc1ccc(cc1)C 1458a_100000182360_200000210301 [0,0,0,0,0,2|0,0,0]=2 7460 B12R1.21 CC(=O)COc1ccc(cc1)Cl 1458a_100016990877_200000210301 [0,0,0,0,0,2|1,0,0]=3 7461 B12R1.21 CC(=O)COc1ccc(cc1)F 1458a_100000184765_200000210301 [0,0,0,0,0,2|1,0,0]=3 7462 B12R1.21 CC(=O)COc1ccc(cc1)I 1458a_100000184369_200000210301 [0,0,0,0,0,2|1,0,0]=3 7463 B12R1.21 CC(=O)COc1ccc(cc1)O 1458a_100000031633_200000210301 [0,0,0,0,0,2|1,0,0]=3 7464 B12R1.21 CC(=O)CSc1ccc(cc1)Br 1458a_100000179496_200000210301 [0,0,0,0,0,2|1,0,0]=3 7465 B12R1.21 CC(=O)CSc1ccc(cc1)C 1458a_100000179497_200000210301 [0,0,0,0,0,2|0,0,0]=2 7466 B12R1.21 CC(=O)CSc1ccc(cc1)Cl 1458a_100000178402_200000210301 [0,0,0,0,0,2|1,0,0]=3 7467 B12R1.21 CC(=O)CSc1ccc(cc1)F 1458a_100000691584_200000210301 [0,0,0,0,0,2|1,0,0]=3 7468 B12R1.21 CC(=O)NCc1ccc(cc1)Br 11a_100000174875_100015343762 [0,0,0,0,0,2|1,0,0]=3 7469 B12R1.21 CC(=O)NCc1ccc(cc1)Br 1626a_100000174875_100015343762 [0,0,0,0,0,2|1,0,0]=3 7470 B12R1.21 CC(=O)NCc1ccc(cc1)Br 240690a_100000174875_100015343762 [0,0,0,0,0,2|1,0,0]=3 7471 B12R1.21 CC(=O)NCc1ccc(cc1)Br 527a_100000174875_100103153847 [0,0,0,0,0,2|1,0,0]=3 7472 B12R1.21 CC(=O)NCc1ccc(cc1)C 11a_100000174908_100015343762 [0,0,0,0,0,2|0,0,0]=2 7473 B12R1.21 CC(=O)NCc1ccc(cc1)C 1626a_100000174908_100015343762 [0,0,0,0,0,2|0,0,0]=2 7474 B12R1.21 CC(=O)NCc1ccc(cc1)C 240690a_100000174908_100015343762 [0,0,0,0,0,2|0,0,0]=2 7475 B12R1.21 CC(=O)NCc1ccc(cc1)C 527a_100000174908_100103153847 [0,0,0,0,0,2|0,0,0]=2 7476 B12R1.21 CC(=O)NCc1ccc(cc1)Cl 11a_100000174871_100015343762 [0,0,0,0,0,2|1,0,0]=3 7477 B12R1.21 CC(=O)NCc1ccc(cc1)Cl 1626a_100000174871_100015343762 [0,0,0,0,0,2|1,0,0]=3 7478 B12R1.21 CC(=O)NCc1ccc(cc1)Cl 240690a_100000174871_100015343762 [0,0,0,0,0,2|1,0,0]=3 7479 B12R1.21 CC(=O)NCc1ccc(cc1)Cl 527a_100000174871_100103153847 [0,0,0,0,0,2|1,0,0]=3 7480 B12R1.21 CC(=O)NCc1ccc(cc1)F 11a_100000174882_100015343762 [0,0,0,0,0,2|1,0,0]=3 7481 B12R1.21 CC(=O)NCc1ccc(cc1)F 1626a_100000174882_100015343762 [0,0,0,0,0,2|1,0,0]=3 7482 B12R1.21 CC(=O)NCc1ccc(cc1)F 240690a_100000174882_100015343762 [0,0,0,0,0,2|1,0,0]=3 7483 B12R1.21 CC(=O)NCc1ccc(cc1)F 527a_100000174882_100103153847 [0,0,0,0,0,2|1,0,0]=3 7484 B12R1.21 CC(=O)NCc1ccc(cc1)I 11a_100016989417_100015343762 [0,0,0,0,0,2|1,0,0]=3 7485 B12R1.21 CC(=O)NCc1ccc(cc1)I 1626a_100016989417_100015343762 [0,0,0,0,0,2|1,0,0]=3 7486 B12R1.21 CC(=O)NCc1ccc(cc1)I 240690a_100016989417_100015343762 [0,0,0,0,0,2|1,0,0]=3 7487 B12R1.21 CC(=O)NCc1ccc(cc1)I 527a_100016989417_100103153847 [0,0,0,0,0,2|1,0,0]=3 7488 B12R1.21 CC(=O)NCc1ccc(cc1)O 240690a_100000185549_100015343762 [0,0,0,0,0,2|1,0,0]=3 7489 B12R1.21 CC(=O)NCc1ccc(cc1)O 271570a_203496583355_200000685173 [0,0,0,0,0,2|1,0,0]=3 7490 B12R1.21 CC(=O)NCc1ccc(cc1)O 527a_100000185549_100103153847 [0,0,0,0,0,2|1,0,0]=3 7491 B12R1.21 CC(=O)NCc1ccc(cn1)Br 11a_100015188789_100015343762 [0,0,0,0,0,2|2,0,0]=4 7492 B12R1.21 CC(=O)NCc1ccc(cn1)Br 1626a_100015188789_100015343762 [0,0,0,0,0,2|2,0,0]=4 7493 B12R1.21 CC(=O)NCc1ccc(cn1)Br 240690a_100015188789_100015343762 [0,0,0,0,0,2|2,0,0]=4 7494 B12R1.21 CC(=O)NCc1ccc(cn1)Br 527a_100015188789_100103153847 [0,0,0,0,0,2|2,0,0]=4 7495 B12R1.21 CC(=O)NCc1ccc(cn1)C 11a_100015187455_100015343762 [0,0,0,0,0,2|1,0,0]=3 7496 B12R1.21 CC(=O)NCc1ccc(cn1)C 1626a_100015187455_100015343762 [0,0,0,0,0,2|1,0,0]=3 7497 B12R1.21 CC(=O)NCc1ccc(cn1)C 240690a_100015187455_100015343762 [0,0,0,0,0,2|1,0,0]=3 7498 B12R1.21 CC(=O)NCc1ccc(cn1)C 527a_100015187455_100103153847 [0,0,0,0,0,2|1,0,0]=3 7499 B12R1.21 CC(=O)NCc1ccc(cn1)Cl 11a_100000697193_100015343762 [0,0,0,0,0,2|2,0,0]=4 7500 B12R1.21 CC(=O)NCc1ccc(cn1)Cl 1626a_100000697193_100015343762 [0,0,0,0,0,2|2,0,0]=4 7501 B12R1.21 CC(=O)NCc1ccc(cn1)Cl 240690a_100000697193_100015343762 [0,0,0,0,0,2|2,0,0]=4 7502 B12R1.21 CC(=O)NCc1ccc(cn1)Cl 527a_100000697193_100103153847 [0,0,0,0,0,2|2,0,0]=4 7503 B12R1.21 CC(=O)NCc1ccc(cn1)F 11a_100020620131_100015343762 [0,0,0,0,0,2|2,0,0]=4 7504 B12R1.21 CC(=O)NCc1ccc(cn1)F 1626a_100020620131_100015343762 [0,0,0,0,0,2|2,0,0]=4 7505 B12R1.21 CC(=O)NCc1ccc(cn1)F 240690a_100020620131_100015343762 [0,0,0,0,0,2|2,0,0]=4 7506 B12R1.21 CC(=O)NCc1ccc(cn1)F 527a_100020620131_100103153847 [0,0,0,0,0,2|2,0,0]=4 7507 B12R1.21 CC(=O)NCc1ccc(cn1)O 240690a_100020605196_100015343762 [0,0,0,0,0,2|2,0,0]=4 7508 B12R1.21 CC(=O)NCc1ccc(nc1)Br 11a_100009817727_100015343762 [0,0,0,0,0,2|2,0,0]=4 7509 B12R1.21 CC(=O)NCc1ccc(nc1)Br 240690a_100009817727_100015343762 [0,0,0,0,0,2|2,0,0]=4 7510 B12R1.21 CC(=O)NCc1ccc(nc1)Br 527a_100009817727_100103153847 [0,0,0,0,0,2|2,0,0]=4 7511 B12R1.21 CC(=O)NCc1ccc(nc1)C 11a_100000740942_100015343762 [0,0,0,0,0,2|1,0,0]=3 7512 B12R1.21 CC(=O)NCc1ccc(nc1)C 1626a_100000740942_100015343762 [0,0,0,0,0,2|1,0,0]=3 7513 B12R1.21 CC(=O)NCc1ccc(nc1)C 240690a_100000740942_100015343762 [0,0,0,0,0,2|1,0,0]=3 7514 B12R1.21 CC(=O)NCc1ccc(nc1)C 527a_100000740942_100103153847 [0,0,0,0,0,2|1,0,0]=3 7515 B12R1.21 CC(=O)NCc1ccc(nc1)Cl 11a_100000735879_100015343762 [0,0,0,0,0,2|2,0,0]=4 7516 B12R1.21 CC(=O)NCc1ccc(nc1)Cl 1626a_100000735879_100015343762 [0,0,0,0,0,2|2,0,0]=4 7517 B12R1.21 CC(=O)NCc1ccc(nc1)Cl 240690a_100000735879_100015343762 [0,0,0,0,0,2|2,0,0]=4 7518 B12R1.21 CC(=O)NCc1ccc(nc1)Cl 527a_100000735879_100103153847 [0,0,0,0,0,2|2,0,0]=4 7519 B12R1.21 CC(=O)NCc1ccc(nc1)F 11a_100000101913_100015343762 [0,0,0,0,0,2|2,0,0]=4 7520 B12R1.21 CC(=O)NCc1ccc(nc1)F 1626a_100000101913_100015343762 [0,0,0,0,0,2|2,0,0]=4 7521 B12R1.21 CC(=O)NCc1ccc(nc1)F 240690a_100000101913_100015343762 [0,0,0,0,0,2|2,0,0]=4 7522 B12R1.21 CC(=O)NCc1ccc(nc1)F 527a_100000101913_100103153847 [0,0,0,0,0,2|2,0,0]=4 7523 B12R1.21 CC(=O)NCc1ccc(nc1)O 11a_100000757128_100015343762 [0,0,0,0,0,2|2,0,0]=4 7524 B12R1.21 CC(=O)NCc1ccc(nc1)O 240690a_100000757128_100015343762 [0,0,0,0,0,2|2,0,0]=4 7525 B12R1.21 CC(=O)NCc1cnc(cn1)C 11a_100132314150_100015343762 [0,0,0,0,0,2|2,0,0]=4 7526 B12R1.21 CC(=O)NCc1cnc(cn1)C 240690a_100132314150_100015343762 [0,0,0,0,0,2|2,0,0]=4 7527 B12R1.21 CC(=O)NCc1cnc(cn1)C 527a_100132314150_100103153847 [0,0,0,0,0,2|2,0,0]=4 7528 B12R1.21 CC(=O)NNc1ccc(cc1)Br 22a_100000735608_100000070787 [0,0,0,0,0,2|1,0,0]=3 7529 B12R1.21 CC(=O)NNc1ccc(cc1)C 22a_100000683527_100000070787 [0,0,0,0,0,2|0,0,0]=2 7530 B12R1.21 CC(=O)NNc1ccc(cc1)Cl 22a_100000683521_100000070787 [0,0,0,0,0,2|1,0,0]=3 7531 B12R1.21 CC(=O)NNc1ccc(cc1)F 22a_100000728448_100000070787 [0,0,0,0,0,2|1,0,0]=3 7532 B12R1.21 CC(=O)NNc1ccc(cc1)I 22a_100016988836_100000070787 [0,0,0,0,0,2|1,0,0]=3 7533 B12R1.21 CC(=O)NNc1ccc(cc1)O 271570a_203496583355_200009815283 [0,0,0,0,0,2|1,0,0]=3 7534 B12R1.21 CC(=O)NNc1ccc(cn1)Br 22a_100000750576_100000070787 [0,0,0,0,0,2|2,0,0]=4 7535 B12R1.21 CC(=O)NNc1ccc(cn1)C 22a_100000746693_100000070787 [0,0,0,0,0,2|1,0,0]=3 7536 B12R1.21 CC(=O)NNc1ccc(cn1)Cl 22a_100011206499_100000070787 [0,0,0,0,0,2|2,0,0]=4 7537 B12R1.21 CC(=O)NNc1ccc(cn1)F 22a_100000753838_100000070787 [0,0,0,0,0,2|2,0,0]=4 7538 B12R1.21 CC(=O)NNc1ccc(cn1)I 22a_100010221006_100000070787 [0,0,0,0,0,2|2,0,0]=4 7539 B12R1.21 CC(=O)NNc1ccc(cn1)O 271570a_203496583355_200010175596 [0,0,0,0,0,2|2,0,0]=4 7540 B12R1.21 CC(=O)NNc1ccc(nc1)Br 22a_100000755011_100000070787 [0,0,0,0,0,2|2,0,0]=4 7541 B12R1.21 CC(=O)NNc1ccc(nc1)C 22a_100020639869_100000070787 [0,0,0,0,0,2|1,0,0]=3 7542 B12R1.21 CC(=O)NNc1ccc(nc1)Cl 22a_100000119030_100000070787 [0,0,0,0,0,2|2,0,0]=4 7543 B12R1.21 CC(=O)NNc1ccc(nc1)F 22a_100000120849_100000070787 [0,0,0,0,0,2|2,0,0]=4 7544 B12R1.21 CC(=O)NNc1ccc(nn1)C 22a_100000747182_100000070787 [0,0,0,0,0,2|2,0,0]=4 7545 B12R1.21 CC(=O)NNc1ncc(cn1)C 22a_100011824989_100000070787 [0,0,0,0,0,2|2,0,0]=4 7546 B12R1.21 Cc1ccc(cc1)C=CC(=O)[13CH3] 1458a_100000716854_200025704644 [0,0,0,0,0,2|0,0,0]=2 7547 B12R1.21 Cc1ccc(cc1)C=CC(C)C 271570a_100016257149_100000186775 [0,0,0,0,0,2|1,0,1]=4 7548 B12R1.21 Cc1ccc(cc1)C=CC(C)O 271570a_200011019289_100000186775 [0,0,0,0,0,2|0,0,2]=4 7549 B12R1.21 Cc1ccc(cc1)CCC(=O)[13CH3] 1458a_100000234883_200025704644 [0,0,0,0,0,2|0,0,0]=2 7550 B12R1.21 Cc1ccc(cc1)CCN(C)C 2230a_100102631434_100011713686 [0,0,0,0,0,2|2,0,0]=4 7551 B12R1.21 Cc1ccc(cc1)CCN(C)C 269982a_100102631434_100011713686 [0,0,0,0,0,2|2,0,0]=4 7552 B12R1.21 Cc1ccc(cc1)CNC(C)C 207a_100138425928_100000211033 [0,0,0,0,0,2|1,0,1]=4 7553 B12R1.21 Cc1ccc(cc1)CNC(C)C 2230a_100000174908_100000210206 [0,0,0,0,0,2|1,0,1]=4 7554 B12R1.21 Cc1ccc(cc1)CNC(C)C 2230a_100138425928_100000210814 [0,0,0,0,0,2|1,0,1]=4 7555 B12R1.21 Cc1ccc(cc1)CNC(C)C 34a_100000174908_100000210206 [0,0,0,0,0,2|1,0,1]=4 7556 B12R1.21 Cc1ccc(cc1)CNC(C)C 34a_100138425928_100000210814 [0,0,0,0,0,2|1,0,1]=4 7557 B12R1.21 Cc1ccc(cc1)COC(C)C 34a_100000212225_100000210814 [0,0,0,0,0,2|1,0,1]=4 7558 B12R1.21 Cc1ccc(cc1)COC(C)C 34a_100011215236_100000210206 [0,0,0,0,0,2|1,0,1]=4 7559 B12R1.21 Cc1ccc(cc1)COC(C)C 7a_100011215236_100000210206 [0,0,0,0,0,2|1,0,1]=4 7560 B12R1.21 Cc1ccc(cc1)CSC(C)C 62a_100000210206_100000210814 [0,0,0,0,0,2|1,0,1]=4 7561 B12R1.21 Cc1ccc(cc1)CSC(C)C 62a_100000210814_100000210206 [0,0,0,0,0,2|1,0,1]=4 7562 B12R1.21 Cc1ccc(cc1)NCC(=O)N 34a_100000124888_100000187820 [0,0,0,0,0,2|1,0,0]=3 7563 B12R1.21 Cc1ccc(cc1)NCC(=O)[O-] 34a_100000124888_100020667443 [0,0,0,0,0,2|1,0,0]=3 7564 B12R1.21 Cc1ccc(cc1)NCC(C)C 34a_100000124888_100000210624 [0,0,0,0,0,2|1,0,1]=4 7565 B12R1.21 Cc1ccc(cc1)NCC(C)O 34a_100000124888_100011218427 [0,0,0,0,0,2|0,0,2]=4 7566 B12R1.21 Cc1ccc(cc1)NC[C@@H](C)O 34a_100000124888_100009817552 [0,0,0,0,0,2|0,0,2]=4 7567 B12R1.21 Cc1ccc(cc1)NC[N+](=O)[O-] 34a_100000124888_100000761209 [0,0,0,0,0,2|2,0,0]=4 7568 B12R1.21 Cc1ccc(cc1)OCC(=O)N 34a_100000210336_100000187820 [0,0,0,0,0,2|1,0,0]=3 7569 B12R1.21 Cc1ccc(cc1)OCC(=O)N 7a_100000210336_100000187820 [0,0,0,0,0,2|1,0,0]=3 7570 B12R1.21 Cc1ccc(cc1)OCC(=O)[13CH3] 1458a_100000182360_200025704644 [0,0,0,0,0,2|0,0,0]=2 7571 B12R1.21 Cc1ccc(cc1)OCC(=O)[O-] 34a_100000210336_100020667443 [0,0,0,0,0,2|1,0,0]=3 7572 B12R1.21 Cc1ccc(cc1)OCC(C)C 34a_100000210336_100000210624 [0,0,0,0,0,2|1,0,1]=4 7573 B12R1.21 Cc1ccc(cc1)OCC(C)C 7a_100000210336_100000210760 [0,0,0,0,0,2|1,0,1]=4 7574 B12R1.21 Cc1ccc(cc1)OCC(C)O 34a_100000210336_100011218427 [0,0,0,0,0,2|0,0,2]=4 7575 B12R1.21 Cc1ccc(cc1)OCC(C)O 7a_100000210336_100011218427 [0,0,0,0,0,2|0,0,2]=4 7576 B12R1.21 Cc1ccc(cc1)OC[C@@H](C)O 34a_100000210336_100009817552 [0,0,0,0,0,2|0,0,2]=4 7577 B12R1.21 Cc1ccc(cc1)OC[C@@H](C)O 7a_100000210336_100009817552 [0,0,0,0,0,2|0,0,2]=4 7578 B12R1.21 Cc1ccc(cc1)OC[N+](=O)[O-] 34a_100000210336_100000761209 [0,0,0,0,0,2|2,0,0]=4 7579 B12R1.21 Cc1ccc(cc1)SCC(=O)N 62a_100000186775_100000747473 [0,0,0,0,0,2|1,0,0]=3 7580 B12R1.21 Cc1ccc(cc1)SCC(=O)N 62a_100000747473_100000186775 [0,0,0,0,0,2|1,0,0]=3 7581 B12R1.21 Cc1ccc(cc1)SCC(=O)[13CH3] 1458a_100000179497_200025704644 [0,0,0,0,0,2|0,0,0]=2 7582 B12R1.21 Cc1ccc(cc1)SCC(=O)[O-] 62a_100000186775_100020667443 [0,0,0,0,0,2|1,0,0]=3 7583 B12R1.21 Cc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000186775 [0,0,0,0,0,2|1,0,0]=3 7584 B12R1.21 Cc1ccc(cc1)SCC(C)C 62a_100000186775_100000210760 [0,0,0,0,0,2|1,0,1]=4 7585 B12R1.21 Cc1ccc(cc1)SCC(C)C 62a_100000210624_100000186775 [0,0,0,0,0,2|1,0,1]=4 7586 B12R1.21 Cc1ccc(cc1)SCC(C)O 62a_100000186775_100011218427 [0,0,0,0,0,2|0,0,2]=4 7587 B12R1.21 Cc1ccc(cc1)SCC(C)O 62a_100011218427_100000186775 [0,0,0,0,0,2|0,0,2]=4 7588 B12R1.21 Cc1ccc(cc1)SC[C@@H](C)O 62a_100000186775_100009817552 [0,0,0,0,0,2|0,0,2]=4 7589 B12R1.21 Cc1ccc(cc1)SC[C@@H](C)O 62a_100009817552_100000186775 [0,0,0,0,0,2|0,0,2]=4 7590 B12R1.21 Cc1ccc(cc1)SC[N+](=O)[O-] 62a_100000186775_100000761209 [0,0,0,0,0,2|2,0,0]=4 7591 B12R1.21 Cc1ccc(cn1)OCC(=O)N 34a_100000745506_100000187820 [0,0,0,0,0,2|2,0,0]=4 7592 B12R1.21 Cc1ccc(cn1)OCC(=O)N 7a_100000745506_100000187820 [0,0,0,0,0,2|2,0,0]=4 7593 B12R1.21 Cc1ccc(cn1)OCC(=O)[O-] 34a_100000745506_100020667443 [0,0,0,0,0,2|2,0,0]=4 7594 B12R1.21 Cc1ccc(cn1)SCC(=O)N 62a_100000747473_100000751577 [0,0,0,0,0,2|2,0,0]=4 7595 B12R1.21 Cc1ccc(cn1)SCC(=O)N 62a_100000751577_100000747473 [0,0,0,0,0,2|2,0,0]=4 7596 B12R1.21 Cc1ccc(cn1)SCC(=O)[O-] 62a_100000751577_100020667443 [0,0,0,0,0,2|2,0,0]=4 7597 B12R1.21 Cc1ccc(cn1)SCC(=O)[O-] 62a_100020667443_100000751577 [0,0,0,0,0,2|2,0,0]=4 7598 B12R1.21 Cc1ccc(nc1)OCC(=O)N 34a_100000759353_100000187820 [0,0,0,0,0,2|2,0,0]=4 7599 B12R1.21 Cc1ccc(nc1)OCC(=O)[O-] 34a_100000759353_100020667443 [0,0,0,0,0,2|2,0,0]=4 7600 B12R1.21 Cc1ccc(nc1)SCC(=O)N 62a_100000747473_100000754016 [0,0,0,0,0,2|2,0,0]=4 7601 B12R1.21 Cc1ccc(nc1)SCC(=O)N 62a_100011192072_100000747473 [0,0,0,0,0,2|2,0,0]=4 7602 B12R1.21 Cc1ccc(nc1)SCC(=O)[O-] 62a_100011192072_100020667443 [0,0,0,0,0,2|2,0,0]=4 7603 B12R1.21 Cc1ccc(nc1)SCC(=O)[O-] 62a_100020667443_100000754016 [0,0,0,0,0,2|2,0,0]=4 7604 B12R1.21 NC(=O)CCc1ccc(cc1)O 271570a_203496583355_200010110666 [0,0,0,0,0,2|2,0,0]=4 7605 B12R1.21 NC(=O)CNc1ccc(cc1)Br 2230a_100000210018_100000747473 [0,0,0,0,0,2|2,0,0]=4 7606 B12R1.21 NC(=O)CNc1ccc(cc1)Br 34a_100000210018_100000187820 [0,0,0,0,0,2|2,0,0]=4 7607 B12R1.21 NC(=O)CNc1ccc(cc1)Cl 2230a_100000210052_100000747473 [0,0,0,0,0,2|2,0,0]=4 7608 B12R1.21 NC(=O)CNc1ccc(cc1)Cl 34a_100000210052_100000187820 [0,0,0,0,0,2|2,0,0]=4 7609 B12R1.21 NC(=O)CNc1ccc(cc1)F 34a_100000185862_100000187820 [0,0,0,0,0,2|2,0,0]=4 7610 B12R1.21 NC(=O)CNc1ccc(cc1)I 34a_100000185761_100000187820 [0,0,0,0,0,2|2,0,0]=4 7611 B12R1.21 NC(=O)CNc1ccc(cc1)O 34a_100000185829_100000187820 [0,0,0,0,0,2|2,0,0]=4 7612 B12R1.21 NC(=O)COc1ccc(cc1)Br 34a_100000185759_100000187820 [0,0,0,0,0,2|2,0,0]=4 7613 B12R1.21 NC(=O)COc1ccc(cc1)Br 7a_100000185759_100000187820 [0,0,0,0,0,2|2,0,0]=4 7614 B12R1.21 NC(=O)COc1ccc(cc1)Cl 34a_100000210216_100000187820 [0,0,0,0,0,2|2,0,0]=4 7615 B12R1.21 NC(=O)COc1ccc(cc1)Cl 7a_100000210216_100000187820 [0,0,0,0,0,2|2,0,0]=4 7616 B12R1.21 NC(=O)COc1ccc(cc1)F 34a_100000210339_100000187820 [0,0,0,0,0,2|2,0,0]=4 7617 B12R1.21 NC(=O)COc1ccc(cc1)I 34a_100000212066_100000187820 [0,0,0,0,0,2|2,0,0]=4 7618 B12R1.21 NC(=O)COc1ccc(cc1)I 7a_100000212066_100000187820 [0,0,0,0,0,2|2,0,0]=4 7619 B12R1.21 NC(=O)COc1ccc(cc1)N 34a_100000185829_100000187820 [0,0,0,0,0,2|2,0,0]=4 7620 B12R1.21 NC(=O)CSc1ccc(cc1)Br 62a_100000747473_100000752885 [0,0,0,0,0,2|2,0,0]=4 7621 B12R1.21 NC(=O)CSc1ccc(cc1)Br 62a_100000752885_100000747473 [0,0,0,0,0,2|2,0,0]=4 7622 B12R1.21 NC(=O)CSc1ccc(cc1)Cl 62a_100000747473_100000755918 [0,0,0,0,0,2|2,0,0]=4 7623 B12R1.21 NC(=O)CSc1ccc(cc1)Cl 62a_100000755918_100000747473 [0,0,0,0,0,2|2,0,0]=4 7624 B12R1.21 NC(=O)CSc1ccc(cc1)F 62a_100000211213_100000747473 [0,0,0,0,0,2|2,0,0]=4 7625 B12R1.21 NC(=O)CSc1ccc(cc1)F 62a_100000747473_100000211213 [0,0,0,0,0,2|2,0,0]=4 7626 B12R1.21 NC(=O)CSc1ccc(cc1)N 62a_100000185761_100000747473 [0,0,0,0,0,2|2,0,0]=4 7627 B12R1.21 NC(=O)CSc1ccc(cc1)N 62a_100000747473_100000185761 [0,0,0,0,0,2|2,0,0]=4 7628 B12R1.21 NC(=O)CSc1ccc(cc1)O 271570a_203496583355_100000149456 [0,0,0,0,0,2|2,0,0]=4 7629 B12R1.21 NC(=O)CSc1ccc(cc1)O 62a_100000747473_100000185759 [0,0,0,0,0,2|2,0,0]=4 7630 B12R1.21 Nc1ccc(cc1)OCC(=O)[O-] 34a_100000185829_100020667443 [0,0,0,0,0,2|2,0,0]=4 7631 B12R1.21 Nc1ccc(cc1)SCC(=O)[O-] 62a_100000185761_100020667443 [0,0,0,0,0,2|2,0,0]=4 7632 B12R1.21 Nc1ccc(cc1)SCC(=O)[O-] 62a_100020667443_100000185761 [0,0,0,0,0,2|2,0,0]=4 7633 B12R1.21 O=C([O-])CNc1ccc(cc1)Br 34a_100000210018_100020667443 [0,0,0,0,0,2|2,0,0]=4 7634 B12R1.21 O=C([O-])CNc1ccc(cc1)Cl 34a_100000210052_100020667443 [0,0,0,0,0,2|2,0,0]=4 7635 B12R1.21 O=C([O-])CNc1ccc(cc1)F 34a_100000185862_100020667443 [0,0,0,0,0,2|2,0,0]=4 7636 B12R1.21 O=C([O-])CNc1ccc(cc1)I 34a_100000185761_100020667443 [0,0,0,0,0,2|2,0,0]=4 7637 B12R1.21 O=C([O-])CNc1ccc(cc1)O 34a_100000185829_100020667443 [0,0,0,0,0,2|2,0,0]=4 7638 B12R1.21 O=C([O-])COc1ccc(cc1)Br 34a_100000185759_100020667443 [0,0,0,0,0,2|2,0,0]=4 7639 B12R1.21 O=C([O-])COc1ccc(cc1)Cl 34a_100000210216_100020667443 [0,0,0,0,0,2|2,0,0]=4 7640 B12R1.21 O=C([O-])COc1ccc(cc1)F 34a_100000210339_100020667443 [0,0,0,0,0,2|2,0,0]=4 7641 B12R1.21 O=C([O-])COc1ccc(cc1)I 34a_100000212066_100020667443 [0,0,0,0,0,2|2,0,0]=4 7642 B12R1.21 O=C([O-])CSc1ccc(cc1)Br 62a_100000752885_100020667443 [0,0,0,0,0,2|2,0,0]=4 7643 B12R1.21 O=C([O-])CSc1ccc(cc1)Br 62a_100020667443_100000752885 [0,0,0,0,0,2|2,0,0]=4 7644 B12R1.21 O=C([O-])CSc1ccc(cc1)Cl 62a_100000755918_100020667443 [0,0,0,0,0,2|2,0,0]=4 7645 B12R1.21 O=C([O-])CSc1ccc(cc1)Cl 62a_100020667443_100000755918 [0,0,0,0,0,2|2,0,0]=4 7646 B12R1.21 O=C([O-])CSc1ccc(cc1)F 62a_100000211213_100020667443 [0,0,0,0,0,2|2,0,0]=4 7647 B12R1.21 O=C([O-])CSc1ccc(cc1)F 62a_100020667443_100000211213 [0,0,0,0,0,2|2,0,0]=4 7648 B12R1.21 O=C([O-])CSc1ccc(cc1)O 62a_100020667443_100000185759 [0,0,0,0,0,2|2,0,0]=4 7649 B12R1.21 [13CH3]C(=O)C#Cc1ccc(cc1)Br 1458a_100012100275_200025704644 [0,0,0,0,0,2|1,0,0]=3 7650 B12R1.21 [13CH3]C(=O)C#Cc1ccc(cc1)Cl 1458a_100011892723_200025704644 [0,0,0,0,0,2|1,0,0]=3 7651 B12R1.21 [13CH3]C(=O)C#Cc1ccc(cc1)F 1458a_100000238512_200025704644 [0,0,0,0,0,2|1,0,0]=3 7652 B12R1.21 [13CH3]C(=O)C=Cc1ccc(cc1)Br 1458a_100016267368_200025704644 [0,0,0,0,0,2|1,0,0]=3 7653 B12R1.21 [13CH3]C(=O)C=Cc1ccc(cc1)Cl 1458a_100000184863_200025704644 [0,0,0,0,0,2|1,0,0]=3 7654 B12R1.21 [13CH3]C(=O)C=Cc1ccc(cc1)F 1458a_100000182136_200025704644 [0,0,0,0,0,2|1,0,0]=3 7655 B12R1.21 [13CH3]C(=O)C=Cc1ccc(cc1)I 1458a_100102526154_200025704644 [0,0,0,0,0,2|1,0,0]=3 7656 B12R1.21 [13CH3]C(=O)C=Cc1ccc(cn1)F 1458a_100020630499_200025704644 [0,0,0,0,0,2|2,0,0]=4 7657 B12R1.21 [13CH3]C(=O)C=Cc1ccc(nc1)Br 1458a_100020588214_200025704644 [0,0,0,0,0,2|2,0,0]=4 7658 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)Br 1458a_100000217147_200025704644 [0,0,0,0,0,2|1,0,0]=3 7659 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)Cl 1458a_100000235379_200025704644 [0,0,0,0,0,2|1,0,0]=3 7660 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)F 1458a_100000198493_200025704644 [0,0,0,0,0,2|1,0,0]=3 7661 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)I 1458a_100011217499_200025704644 [0,0,0,0,0,2|1,0,0]=3 7662 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)O 1458a_100000742835_200025704644 [0,0,0,0,0,2|1,0,0]=3 7663 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)Br 1458a_100000182358_200025704644 [0,0,0,0,0,2|1,0,0]=3 7664 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)Cl 1458a_100016990877_200025704644 [0,0,0,0,0,2|1,0,0]=3 7665 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)F 1458a_100000184765_200025704644 [0,0,0,0,0,2|1,0,0]=3 7666 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)I 1458a_100000184369_200025704644 [0,0,0,0,0,2|1,0,0]=3 7667 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)O 1458a_100000031633_200025704644 [0,0,0,0,0,2|1,0,0]=3 7668 B12R1.21 [13CH3]C(=O)CSc1ccc(cc1)Br 1458a_100000179496_200025704644 [0,0,0,0,0,2|1,0,0]=3 7669 B12R1.21 [13CH3]C(=O)CSc1ccc(cc1)Cl 1458a_100000178402_200025704644 [0,0,0,0,0,2|1,0,0]=3 7670 B12R1.21 [13CH3]C(=O)CSc1ccc(cc1)F 1458a_100000691584_200025704644 [0,0,0,0,0,2|1,0,0]=3